N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide

C23H37N3O2 — CID 26322525

IUPACN-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide
SMILESO=C(c1ccco1)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1
InChIInChI=1S/C23H37N3O2/c27-23(22-11-7-17-28-22)26(16-15-24-12-4-1-5-13-24)19-20-8-6-14-25(18-20)21-9-2-3-10-21/h7,11,17,20-21H,1-6,8-10,12-16,18-19H2/t20-/m0/s1
InChIKeyINWQANQNCFKPAJ-FQEVSTJZSA-N
MW387.57 g/mol
LogP3.86
Rot. Bonds7

About N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide

N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide (PubChem CID 26322525) has the molecular formula C23H37N3O2 and a molecular weight of 387.57 g/mol. Its IUPAC name is N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide.

Molecular Properties

Compound NameN-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide
PubChem CID26322525
Molecular FormulaC23H37N3O2
Molecular Weight387.57 g/mol
Exact Mass387.29
IUPAC NameN-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide
SMILESO=C(c1ccco1)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1
InChIInChI=1S/C23H37N3O2/c27-23(22-11-7-17-28-22)26(16-15-24-12-4-1-5-13-24)19-20-8-6-14-25(18-20)21-9-2-3-10-21/h7,11,17,20-21H,1-6,8-10,12-16,18-19H2/t20-/m0/s1
InChIKeyINWQANQNCFKPAJ-FQEVSTJZSA-N
XLogP3.86
TPSA39.93 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms28
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500387.57
LogP ≤ 53.86
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

Analyze N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide with MolForge

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Related Compounds

N-[(1-cyclopentylpiperidin-3-yl)methyl]-N-(2-piperidin-1-ylethyl)thiophene-2-carboxamide
CID 24817642
N-[(1-cyclopentylpiperidin-3-yl)methyl]-2-ethyl-5-methyl-N-(2-piperidin-1-ylethyl)pyrazole-3-carboxamide
CID 45221726
N-[(1-cyclopentylpiperidin-3-yl)methyl]-2-methylsulfanyl-N-(2-piperidin-1-ylethyl)acetamide
CID 45186777
N-[(1-cyclopentylpiperidin-3-yl)methyl]-N-(2-piperidin-1-ylethyl)pent-4-enamide
CID 45195885
1-[3-[[[(3S)-1-cyclopentylpiperidin-3-yl]methyl-(2-piperidin-1-ylethyl)amino]methyl]phenyl]ethanone
CID 28822180
1-N'-[(1-cyclopentylpiperidin-3-yl)methyl]-1-N'-(2-piperidin-1-ylethyl)cyclopropane-1,1-dicarboxamide
CID 45247149
N-[[(3R)-1-cyclohexylpiperidin-3-yl]methyl]-N-(pyridin-3-ylmethyl)pyrrolidine-1-carboxamide
CID 97281081
1-[4-[[[(3S)-1-cyclopentylpiperidin-3-yl]methyl-(2-piperidin-1-ylethyl)amino]methyl]thiophen-2-yl]ethanone
CID 29085541
N-[[(3R)-1-cyclopentylpiperidin-3-yl]methyl]-N-[[5-(methoxymethyl)furan-2-yl]methyl]-2-piperidin-1-ylethanamine
CID 29188747
(3S)-1-cyclohexyl-N-(furan-2-ylmethyl)-N-(2-hydroxyethyl)piperidine-3-carboxamide
CID 95119803
N-[[(3S)-1-cyclohexylpiperidin-3-yl]methyl]-2-(2-oxopiperidin-1-yl)-N-(pyridin-3-ylmethyl)acetamide
CID 42293272
N-[[(3R)-1-cyclohexylpiperidin-3-yl]methyl]-3-methoxy-N-(pyridin-3-ylmethyl)propanamide
CID 42515288

Frequently Asked Questions

What is the IUPAC name of N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide?
The IUPAC name of N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide (CID 26322525) is N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide.
What is the SMILES notation for N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide?
The canonical SMILES for N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide is O=C(c1ccco1)N(CCN1CCCCC1)C[C@H]1CCCN(C2CCCC2)C1.
What is the InChIKey of N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide?
The InChIKey is INWQANQNCFKPAJ-FQEVSTJZSA-N. The full InChI is InChI=1S/C23H37N3O2/c27-23(22-11-7-17-28-22)26(16-15-24-12-4-1-5-13-24)19-20-8-6-14-25(18-20)21-9-2-3-10-21/h7,11,17,20-21H,1-6,8-10,12-16,18-19H2/t20-/m0/s1.
What are the key properties of N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide?
N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide has a molecular weight of 387.57 g/mol, XLogP of 3.86, 7 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[(3S)-1-cyclopentylpiperidin-3-yl]methyl]-N-(2-piperidin-1-ylethyl)furan-2-carboxamide is sourced from PubChem (CID 26322525), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).