N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide

C17H27N3O2 — CID 86778486

IUPACN-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide
SMILESCc1[nH]ccc1C(=O)N(CCN1CCOCC1)C1CCCC1
InChIInChI=1S/C17H27N3O2/c1-14-16(6-7-18-14)17(21)20(15-4-2-3-5-15)9-8-19-10-12-22-13-11-19/h6-7,15,18H,2-5,8-13H2,1H3
InChIKeyVIOANZQWVNNJSG-UHFFFAOYSA-N
MW305.42 g/mol
LogP2.04
Rot. Bonds5

About N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide

N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide (PubChem CID 86778486) has the molecular formula C17H27N3O2 and a molecular weight of 305.42 g/mol. Its IUPAC name is N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide
PubChem CID86778486
Molecular FormulaC17H27N3O2
Molecular Weight305.42 g/mol
Exact Mass305.21
IUPAC NameN-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide
SMILESCc1[nH]ccc1C(=O)N(CCN1CCOCC1)C1CCCC1
InChIInChI=1S/C17H27N3O2/c1-14-16(6-7-18-14)17(21)20(15-4-2-3-5-15)9-8-19-10-12-22-13-11-19/h6-7,15,18H,2-5,8-13H2,1H3
InChIKeyVIOANZQWVNNJSG-UHFFFAOYSA-N
XLogP2.04
TPSA48.57 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500305.42
LogP ≤ 52.04
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

2,4-dimethoxy-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)benzamide
CID 90607312
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)furan-2-carboxamide
CID 90607378
1-methyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)-6-oxopyridazine-3-carboxamide
CID 90607257
2-methyl-N-(1-methylpiperidin-4-yl)-N-(2-morpholin-4-ylethyl)-4,5,6,7-tetrahydro-1-benzofuran-3-carboxamide
CID 46957646
2-(3-methylphenyl)-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)acetamide
CID 90607368
N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)quinoline-2-carboxamide
CID 90607272
N-[(1-cyclopentylpiperidin-4-yl)methyl]-2-methyl-N-[[(2R)-oxolan-2-yl]methyl]-1H-pyrrole-3-carboxamide
CID 97272542
2,2-dimethyl-N-(2-morpholin-4-ylethyl)-N-(oxan-4-yl)propanamide
CID 90607283
N-(2-chloroethyl)-N-cyclopentyl-2,3-dimethylbenzamide
CID 63391726
3-[cyclopentyl(2-morpholin-4-ylethyl)amino]-2-methylpropanoic acid
CID 82330480
N-(3-morpholin-4-ylpropyl)-N-piperidin-3-ylfuran-2-carboxamide;hydrochloride
CID 146065227
N-[1-(4-methoxyphenyl)piperidin-4-yl]-N-(2-morpholin-4-ylethyl)pyridine-4-carboxamide
CID 95803104

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide?
The IUPAC name of N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide (CID 86778486) is N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide?
The canonical SMILES for N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide is Cc1[nH]ccc1C(=O)N(CCN1CCOCC1)C1CCCC1.
What is the InChIKey of N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide?
The InChIKey is VIOANZQWVNNJSG-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H27N3O2/c1-14-16(6-7-18-14)17(21)20(15-4-2-3-5-15)9-8-19-10-12-22-13-11-19/h6-7,15,18H,2-5,8-13H2,1H3.
What are the key properties of N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide?
N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide has a molecular weight of 305.42 g/mol, XLogP of 2.04, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-methyl-N-(2-morpholin-4-ylethyl)-1H-pyrrole-3-carboxamide is sourced from PubChem (CID 86778486), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).