4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide

C19H30N4O2 — CID 97071232

IUPAC4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide
SMILESCc1ccc([C@H](CNC(=O)N2CCN(C3CC3)CC2)N2CCCC2)o1
InChIInChI=1S/C19H30N4O2/c1-15-4-7-18(25-15)17(22-8-2-3-9-22)14-20-19(24)23-12-10-21(11-13-23)16-5-6-16/h4,7,16-17H,2-3,5-6,8-14H2,1H3,(H,20,24)/t17-/m0/s1
InChIKeyJSFUNBWFXJCXCJ-KRWDZBQOSA-N
MW346.48 g/mol
LogP2.21
Rot. Bonds5

About 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide

4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide (PubChem CID 97071232) has the molecular formula C19H30N4O2 and a molecular weight of 346.48 g/mol. Its IUPAC name is 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide.

Molecular Properties

Compound Name4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide
PubChem CID97071232
Molecular FormulaC19H30N4O2
Molecular Weight346.48 g/mol
Exact Mass346.24
IUPAC Name4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide
SMILESCc1ccc([C@H](CNC(=O)N2CCN(C3CC3)CC2)N2CCCC2)o1
InChIInChI=1S/C19H30N4O2/c1-15-4-7-18(25-15)17(22-8-2-3-9-22)14-20-19(24)23-12-10-21(11-13-23)16-5-6-16/h4,7,16-17H,2-3,5-6,8-14H2,1H3,(H,20,24)/t17-/m0/s1
InChIKeyJSFUNBWFXJCXCJ-KRWDZBQOSA-N
XLogP2.21
TPSA51.96 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms25
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500346.48
LogP ≤ 52.21
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

Analyze 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide with MolForge

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Related Compounds

4-(1-hydroxyethyl)-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperidine-1-carboxamide
CID 111438592
N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]-2-azabicyclo[2.2.1]heptane-2-carboxamide
CID 71880457
4-(cyclohexylmethyl)-N-[2-(5-methylfuran-2-yl)-2-morpholin-4-ylethyl]-1,4-diazepane-1-carboxamide
CID 55911635
3-(dimethylamino)-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]propanamide
CID 75419402
(2R)-2-amino-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]propanamide;dihydrochloride
CID 119873740
N-[(2S)-2-(5-methylfuran-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 26834523
N-[(2R)-2-(5-methylfuran-2-yl)-2-piperidin-1-ylethyl]benzamide
CID 26834521
7-amino-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]heptanamide
CID 119873705
4-bromo-N-[(2R)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 26834649
2-(4-aminophenyl)-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]acetamide
CID 119873717
4-methoxy-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]benzamide
CID 26834639
4-fluoro-N-[2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]benzamide;hydrochloride
CID 146052595

Frequently Asked Questions

What is the IUPAC name of 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide?
The IUPAC name of 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide (CID 97071232) is 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide.
What is the SMILES notation for 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide?
The canonical SMILES for 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide is Cc1ccc([C@H](CNC(=O)N2CCN(C3CC3)CC2)N2CCCC2)o1.
What is the InChIKey of 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide?
The InChIKey is JSFUNBWFXJCXCJ-KRWDZBQOSA-N. The full InChI is InChI=1S/C19H30N4O2/c1-15-4-7-18(25-15)17(22-8-2-3-9-22)14-20-19(24)23-12-10-21(11-13-23)16-5-6-16/h4,7,16-17H,2-3,5-6,8-14H2,1H3,(H,20,24)/t17-/m0/s1.
What are the key properties of 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide?
4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide has a molecular weight of 346.48 g/mol, XLogP of 2.21, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopropyl-N-[(2S)-2-(5-methylfuran-2-yl)-2-pyrrolidin-1-ylethyl]piperazine-1-carboxamide is sourced from PubChem (CID 97071232), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).