N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide

C22H34N2O3 — CID 119784711

IUPACN-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide
SMILESCOc1cccc(CNC(=O)CC(C)C2CCNCC2)c1OC1CCCC1
InChIInChI=1S/C22H34N2O3/c1-16(17-10-12-23-13-11-17)14-21(25)24-15-18-6-5-9-20(26-2)22(18)27-19-7-3-4-8-19/h5-6,9,16-17,19,23H,3-4,7-8,10-15H2,1-2H3,(H,24,25)
InChIKeyGFDYPOGZCURBCX-UHFFFAOYSA-N
MW374.53 g/mol
LogP3.66
Rot. Bonds8

About N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide

N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide (PubChem CID 119784711) has the molecular formula C22H34N2O3 and a molecular weight of 374.53 g/mol. Its IUPAC name is N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide.

Molecular Properties

Compound NameN-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide
PubChem CID119784711
Molecular FormulaC22H34N2O3
Molecular Weight374.53 g/mol
Exact Mass374.26
IUPAC NameN-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide
SMILESCOc1cccc(CNC(=O)CC(C)C2CCNCC2)c1OC1CCCC1
InChIInChI=1S/C22H34N2O3/c1-16(17-10-12-23-13-11-17)14-21(25)24-15-18-6-5-9-20(26-2)22(18)27-19-7-3-4-8-19/h5-6,9,16-17,19,23H,3-4,7-8,10-15H2,1-2H3,(H,24,25)
InChIKeyGFDYPOGZCURBCX-UHFFFAOYSA-N
XLogP3.66
TPSA59.59 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds8
Heavy Atoms27
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500374.53
LogP ≤ 53.66
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-[(2,3-dimethoxyphenyl)methyl]-3-piperidin-4-ylbutanamide
CID 119708893
N-[(2-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119675421
(2S)-2-amino-N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]propanamide
CID 119324261
N-[(2-methoxyphenyl)methyl]-3-piperidin-3-ylbutanamide
CID 81048441
N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]pyrrolidine-2-carboxamide
CID 119324271
N-[[2-(2-methylpropoxy)phenyl]methyl]-3-piperidin-4-ylbutanamide;hydrochloride
CID 119739883
N-[(3,4-dimethoxyphenyl)methyl]-3-piperidin-4-ylbutanamide
CID 119674855
N-(3-cyclopentyloxyphenyl)-3-piperidin-4-ylbutanamide
CID 119714969
N-[2-hydroxy-2-(2-methoxyphenyl)ethyl]-3-piperidin-4-ylbutanamide
CID 119730501
N-[(2-cyclopentyloxy-4-methoxyphenyl)methyl]-3-piperidin-3-ylbutanamide
CID 119802538
N-[[2-(azepan-1-ylmethyl)phenyl]methyl]-3-piperidin-4-ylbutanamide
CID 119869671
4-[(2-cyclobutyloxy-3-methoxyphenyl)methyl]piperidine
CID 117441033

Frequently Asked Questions

What is the IUPAC name of N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide?
The IUPAC name of N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide (CID 119784711) is N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide.
What is the SMILES notation for N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide?
The canonical SMILES for N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide is COc1cccc(CNC(=O)CC(C)C2CCNCC2)c1OC1CCCC1.
What is the InChIKey of N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide?
The InChIKey is GFDYPOGZCURBCX-UHFFFAOYSA-N. The full InChI is InChI=1S/C22H34N2O3/c1-16(17-10-12-23-13-11-17)14-21(25)24-15-18-6-5-9-20(26-2)22(18)27-19-7-3-4-8-19/h5-6,9,16-17,19,23H,3-4,7-8,10-15H2,1-2H3,(H,24,25).
What are the key properties of N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide?
N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide has a molecular weight of 374.53 g/mol, XLogP of 3.66, 8 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-cyclopentyloxy-3-methoxyphenyl)methyl]-3-piperidin-4-ylbutanamide is sourced from PubChem (CID 119784711), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).