2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide

C16H24N4O — CID 80632703

IUPAC2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
SMILESNC(=O)CN(c1ccc(CNC2CC2)cn1)C1CCCC1
InChIInChI=1S/C16H24N4O/c17-15(21)11-20(14-3-1-2-4-14)16-8-5-12(10-19-16)9-18-13-6-7-13/h5,8,10,13-14,18H,1-4,6-7,9,11H2,(H2,17,21)
InChIKeyCUKFSPWHNVNTRM-UHFFFAOYSA-N
MW288.39 g/mol
LogP1.57
Rot. Bonds7

About 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide

2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide (PubChem CID 80632703) has the molecular formula C16H24N4O and a molecular weight of 288.39 g/mol. Its IUPAC name is 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide.

Molecular Properties

Compound Name2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
PubChem CID80632703
Molecular FormulaC16H24N4O
Molecular Weight288.39 g/mol
Exact Mass288.20
IUPAC Name2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
SMILESNC(=O)CN(c1ccc(CNC2CC2)cn1)C1CCCC1
InChIInChI=1S/C16H24N4O/c17-15(21)11-20(14-3-1-2-4-14)16-8-5-12(10-19-16)9-18-13-6-7-13/h5,8,10,13-14,18H,1-4,6-7,9,11H2,(H2,17,21)
InChIKeyCUKFSPWHNVNTRM-UHFFFAOYSA-N
XLogP1.57
TPSA71.25 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds7
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500288.39
LogP ≤ 51.57
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

2-[(2-amino-2-oxoethyl)-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide
CID 80635727
N-cyclopentyl-5-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 62281128
2-[(5-carbamothioyl-2-pyridinyl)-cyclopentylamino]acetamide
CID 54988862
N-cyclopropyl-5-[(cyclopropylamino)methyl]-N-(2,2,2-trifluoroethyl)pyridin-2-amine
CID 62283700
5-[(cyclopentylamino)methyl]pyridine-2-carboxamide
CID 115685055
2-[[5-[(cyclopropylamino)methyl]-2-pyridinyl]-methylamino]-N-ethylacetamide
CID 80629554
N-(cyclobutylmethyl)-5-[(cyclopropylamino)methyl]-N-ethylpyridin-2-amine
CID 107399965
2-[[5-(aminomethyl)-3-methyl-2-pyridinyl]-cyclopentylamino]acetamide
CID 80629884
3-[[5-[(cyclopropylamino)methyl]-2-pyridinyl]-methylamino]-N,2-dimethylpropanamide
CID 106916818
2-[cyclopentyl-[5-(hydroxymethyl)-2-pyridinyl]amino]ethanol
CID 54994646
5-[(cyclopropylamino)methyl]-N-(cyclopropylmethyl)-N-ethylpyridin-2-amine
CID 63940452
5-[(cyclopropylamino)methyl]-N-methyl-N-phenylpyridin-2-amine
CID 62285256

Frequently Asked Questions

What is the IUPAC name of 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide?
The IUPAC name of 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide (CID 80632703) is 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide.
What is the SMILES notation for 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide?
The canonical SMILES for 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide is NC(=O)CN(c1ccc(CNC2CC2)cn1)C1CCCC1.
What is the InChIKey of 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide?
The InChIKey is CUKFSPWHNVNTRM-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H24N4O/c17-15(21)11-20(14-3-1-2-4-14)16-8-5-12(10-19-16)9-18-13-6-7-13/h5,8,10,13-14,18H,1-4,6-7,9,11H2,(H2,17,21).
What are the key properties of 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide?
2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide has a molecular weight of 288.39 g/mol, XLogP of 1.57, 7 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-[cyclopentyl-[5-[(cyclopropylamino)methyl]-2-pyridinyl]amino]acetamide is sourced from PubChem (CID 80632703), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).