3-amino-1-(methylamino)cyclopentane-1-carboxamide

C7H15N3O — CID 23523618

IUPAC3-amino-1-(methylamino)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(N)C1
InChIInChI=1S/C7H15N3O/c1-10-7(6(9)11)3-2-5(8)4-7/h5,10H,2-4,8H2,1H3,(H2,9,11)
InChIKeyBVLUHRIWXFXZIF-UHFFFAOYSA-N
MW157.22 g/mol
LogP-1.06
Rot. Bonds2

About 3-amino-1-(methylamino)cyclopentane-1-carboxamide

3-amino-1-(methylamino)cyclopentane-1-carboxamide (PubChem CID 23523618) has the molecular formula C7H15N3O and a molecular weight of 157.22 g/mol. Its IUPAC name is 3-amino-1-(methylamino)cyclopentane-1-carboxamide.

Molecular Properties

Compound Name3-amino-1-(methylamino)cyclopentane-1-carboxamide
PubChem CID23523618
Molecular FormulaC7H15N3O
Molecular Weight157.22 g/mol
Exact Mass157.12
IUPAC Name3-amino-1-(methylamino)cyclopentane-1-carboxamide
SMILESCNC1(C(N)=O)CCC(N)C1
InChIInChI=1S/C7H15N3O/c1-10-7(6(9)11)3-2-5(8)4-7/h5,10H,2-4,8H2,1H3,(H2,9,11)
InChIKeyBVLUHRIWXFXZIF-UHFFFAOYSA-N
XLogP-1.06
TPSA81.14 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500157.22
LogP ≤ 5-1.06
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclopentane-1-carboxamide
CID 79651474
1-(methylamino)-3-methylsulfanylcyclohexane-1-carboxamide
CID 79634172
3-(4-cyclopropylpiperazin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79641560
1-(methylamino)-4-propylcycloheptane-1-carboxamide
CID 65089354
3-heptoxy-1-(methylamino)cyclopentane-1-carboxamide
CID 79648653
1-(methylamino)-3-(4-methylpentoxy)cyclopentane-1-carboxamide
CID 79649123
3-(3,4-dimethylpyrrolidin-1-yl)-1-(methylamino)cyclohexane-1-carboxamide
CID 79641394
3-(3,5-dimethoxyphenoxy)-1-(methylamino)cyclopentane-1-carboxamide
CID 79646943
1-(methylamino)-3-(4-methylphenoxy)cyclopentane-1-carboxamide
CID 79648973
3-[ethyl(2-ethylbutyl)amino]-1-(methylamino)cyclopentane-1-carboxamide
CID 79654785
3-[3-(methoxymethyl)piperidin-1-yl]-1-(methylamino)cyclopentane-1-carboxamide
CID 106588660
1-(methylamino)-3-(oxetan-3-yloxy)cyclohexane-1-carboxamide
CID 102607420

Frequently Asked Questions

What is the IUPAC name of 3-amino-1-(methylamino)cyclopentane-1-carboxamide?
The IUPAC name of 3-amino-1-(methylamino)cyclopentane-1-carboxamide (CID 23523618) is 3-amino-1-(methylamino)cyclopentane-1-carboxamide.
What is the SMILES notation for 3-amino-1-(methylamino)cyclopentane-1-carboxamide?
The canonical SMILES for 3-amino-1-(methylamino)cyclopentane-1-carboxamide is CNC1(C(N)=O)CCC(N)C1.
What is the InChIKey of 3-amino-1-(methylamino)cyclopentane-1-carboxamide?
The InChIKey is BVLUHRIWXFXZIF-UHFFFAOYSA-N. The full InChI is InChI=1S/C7H15N3O/c1-10-7(6(9)11)3-2-5(8)4-7/h5,10H,2-4,8H2,1H3,(H2,9,11).
What are the key properties of 3-amino-1-(methylamino)cyclopentane-1-carboxamide?
3-amino-1-(methylamino)cyclopentane-1-carboxamide has a molecular weight of 157.22 g/mol, XLogP of -1.06, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 3-amino-1-(methylamino)cyclopentane-1-carboxamide is sourced from PubChem (CID 23523618), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).