1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide

C16H30N4O — CID 79644633

IUPAC1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide
SMILESCCNC1(C(N)=O)CCC(N2CCC(N3CCCC3)C2)C1
InChIInChI=1S/C16H30N4O/c1-2-18-16(15(17)21)7-5-13(11-16)20-10-6-14(12-20)19-8-3-4-9-19/h13-14,18H,2-12H2,1H3,(H2,17,21)
InChIKeyDECQNMTXASQOFL-UHFFFAOYSA-N
MW294.44 g/mol
LogP0.54
Rot. Bonds5

About 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide

1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide (PubChem CID 79644633) has the molecular formula C16H30N4O and a molecular weight of 294.44 g/mol. Its IUPAC name is 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide
PubChem CID79644633
Molecular FormulaC16H30N4O
Molecular Weight294.44 g/mol
Exact Mass294.24
IUPAC Name1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide
SMILESCCNC1(C(N)=O)CCC(N2CCC(N3CCCC3)C2)C1
InChIInChI=1S/C16H30N4O/c1-2-18-16(15(17)21)7-5-13(11-16)20-10-6-14(12-20)19-8-3-4-9-19/h13-14,18H,2-12H2,1H3,(H2,17,21)
InChIKeyDECQNMTXASQOFL-UHFFFAOYSA-N
XLogP0.54
TPSA61.60 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500294.44
LogP ≤ 50.54
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

1-(ethylamino)-3-(4-propan-2-ylazepan-1-yl)cyclopentane-1-carboxamide
CID 79645390
3-(4-cyclopropylpiperazin-1-yl)-1-(ethylamino)cyclohexane-1-carboxamide
CID 79628200
1-(ethylamino)-3-(4-ethyl-3-methylpiperazin-1-yl)cyclopentane-1-carboxamide
CID 79651425
1-(ethylamino)-3-[3-(methoxymethyl)pyrrolidin-1-yl]cyclohexane-1-carboxamide
CID 79641984
1-amino-3-(3-piperidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide
CID 79651841
3-(azocan-1-yl)-1-(propylamino)cyclohexane-1-carboxamide
CID 79628661
3-(3,4,4a,5,6,7,8,8a-octahydro-2H-quinolin-1-yl)-1-(ethylamino)cyclopentane-1-carboxamide
CID 79646112
3-(3,4-dimethoxypyrrolidin-1-yl)-1-(ethylamino)cyclohexane-1-carboxamide
CID 103538166
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
3-(4,4-dimethylpiperidin-1-yl)-1-(ethylamino)cyclopentane-1-carboxylic acid
CID 79651554
1-(ethylamino)-3-hydroxycyclopentane-1-carboxamide
CID 164648441
methyl 3-(azocan-1-yl)-1-(ethylamino)cyclohexane-1-carboxylate
CID 79628664

Frequently Asked Questions

What is the IUPAC name of 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide?
The IUPAC name of 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide (CID 79644633) is 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide.
What is the SMILES notation for 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide?
The canonical SMILES for 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide is CCNC1(C(N)=O)CCC(N2CCC(N3CCCC3)C2)C1.
What is the InChIKey of 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide?
The InChIKey is DECQNMTXASQOFL-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H30N4O/c1-2-18-16(15(17)21)7-5-13(11-16)20-10-6-14(12-20)19-8-3-4-9-19/h13-14,18H,2-12H2,1H3,(H2,17,21).
What are the key properties of 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide?
1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide has a molecular weight of 294.44 g/mol, XLogP of 0.54, 5 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(ethylamino)-3-(3-pyrrolidin-1-ylpyrrolidin-1-yl)cyclopentane-1-carboxamide is sourced from PubChem (CID 79644633), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).