N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide

C19H33N3O2 — CID 119651183

IUPACN-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide
SMILESCNCC1CCCN1C(=O)C1CCC(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H33N3O2/c1-20-13-17-7-4-12-22(17)19(24)15-8-10-16(11-9-15)21-18(23)14-5-2-3-6-14/h14-17,20H,2-13H2,1H3,(H,21,23)
InChIKeyGQUATDMPMKDKHW-UHFFFAOYSA-N
MW335.49 g/mol
LogP2.06
Rot. Bonds5

About N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide

N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide (PubChem CID 119651183) has the molecular formula C19H33N3O2 and a molecular weight of 335.49 g/mol. Its IUPAC name is N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide
PubChem CID119651183
Molecular FormulaC19H33N3O2
Molecular Weight335.49 g/mol
Exact Mass335.26
IUPAC NameN-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide
SMILESCNCC1CCCN1C(=O)C1CCC(NC(=O)C2CCCC2)CC1
InChIInChI=1S/C19H33N3O2/c1-20-13-17-7-4-12-22(17)19(24)15-8-10-16(11-9-15)21-18(23)14-5-2-3-6-14/h14-17,20H,2-13H2,1H3,(H,21,23)
InChIKeyGQUATDMPMKDKHW-UHFFFAOYSA-N
XLogP2.06
TPSA61.44 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms24
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500335.49
LogP ≤ 52.06
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Related Compounds

(4-tert-butylcyclohexyl)-[2-(methylaminomethyl)piperidin-1-yl]methanone
CID 63249081
N-cyclopentyl-2-(methylaminomethyl)pyrrolidine-1-carboxamide
CID 115316412
cyclopent-3-en-1-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 115316381
cyclooctyl-[2-[2-(methylamino)ethyl]piperidin-1-yl]methanone
CID 65023261
1-[(2R)-2-(methylaminomethyl)piperidin-1-yl]ethanone
CID 95037259
[2-(methylaminomethyl)pyrrolidin-1-yl]-(oxolan-3-yl)methanone;hydrochloride
CID 119261296
1-[(2S)-2-(methylaminomethyl)pyrrolidin-1-yl]ethanone
CID 66569273
2,3-dihydro-1H-inden-2-yl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone
CID 106893430
6-bicyclo[3.1.0]hexanyl-[2-(methylaminomethyl)pyrrolidin-1-yl]methanone;hydrochloride
CID 119649432
[2-(methylaminomethyl)piperidin-1-yl]-[(2S)-oxolan-2-yl]methanone
CID 104856232
cyclopentyl-[(2R)-2-(hydroxymethyl)pyrrolidin-1-yl]methanone
CID 79030199
[2-(3-bromopropyl)pyrrolidin-1-yl]-cyclopentylmethanone
CID 80676795

Frequently Asked Questions

What is the IUPAC name of N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide?
The IUPAC name of N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide (CID 119651183) is N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide.
What is the SMILES notation for N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide?
The canonical SMILES for N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide is CNCC1CCCN1C(=O)C1CCC(NC(=O)C2CCCC2)CC1.
What is the InChIKey of N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide?
The InChIKey is GQUATDMPMKDKHW-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H33N3O2/c1-20-13-17-7-4-12-22(17)19(24)15-8-10-16(11-9-15)21-18(23)14-5-2-3-6-14/h14-17,20H,2-13H2,1H3,(H,21,23).
What are the key properties of N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide?
N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide has a molecular weight of 335.49 g/mol, XLogP of 2.06, 5 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[4-[2-(methylaminomethyl)pyrrolidine-1-carbonyl]cyclohexyl]cyclopentanecarboxamide is sourced from PubChem (CID 119651183), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).