(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone

C11H17N3O — CID 116607144

IUPAC(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1nccc1C(=O)C1(C)CCCC1N
InChIInChI=1S/C11H17N3O/c1-11(6-3-4-9(11)12)10(15)8-5-7-13-14(8)2/h5,7,9H,3-4,6,12H2,1-2H3
InChIKeyVTKYGSAWLNKXCP-UHFFFAOYSA-N
MW207.28 g/mol
LogP1.12
Rot. Bonds2

About (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone

(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone (PubChem CID 116607144) has the molecular formula C11H17N3O and a molecular weight of 207.28 g/mol. Its IUPAC name is (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone.

Molecular Properties

Compound Name(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone
PubChem CID116607144
Molecular FormulaC11H17N3O
Molecular Weight207.28 g/mol
Exact Mass207.14
IUPAC Name(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone
SMILESCn1nccc1C(=O)C1(C)CCCC1N
InChIInChI=1S/C11H17N3O/c1-11(6-3-4-9(11)12)10(15)8-5-7-13-14(8)2/h5,7,9H,3-4,6,12H2,1-2H3
InChIKeyVTKYGSAWLNKXCP-UHFFFAOYSA-N
XLogP1.12
TPSA60.91 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500207.28
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

(1-aminocyclopentyl)-(2-methylpyrazol-3-yl)methanone
CID 116558688
(2-amino-1-methylcyclopentyl)-(furan-3-yl)methanone
CID 116607397
(1-hydroxycyclopentyl)-(2-methylpyrazol-3-yl)methanone
CID 103447816
1-(2-amino-1-methylcyclopentyl)-2-(1-methylpyrazol-4-yl)ethanone
CID 116607321
(2-amino-1-methylcyclopentyl)-(4-methoxyphenyl)methanone
CID 116607273
trans-(1S,2R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 55284582
(1R)-2-amino-1-methylcyclopentane-1-carboxylic acid
CID 129318014
1-(2-amino-1-methylcyclopentyl)-2-(1-methylpyrazol-3-yl)ethanone
CID 116607236
(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone
CID 61297196
(2-amino-1-methylcyclopentyl)-(3-chloro-4-methylphenyl)methanone
CID 107561390
1-(2-amino-1-methylcyclopentyl)-2-(2,5-dimethylpyrazol-3-yl)ethanone
CID 116607264
(3-aminopiperidin-1-yl)-(2-methylpyrazol-3-yl)methanone;hydrochloride
CID 119379296

Frequently Asked Questions

What is the IUPAC name of (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone?
The IUPAC name of (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone (CID 116607144) is (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone.
What is the SMILES notation for (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone?
The canonical SMILES for (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone is Cn1nccc1C(=O)C1(C)CCCC1N.
What is the InChIKey of (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone?
The InChIKey is VTKYGSAWLNKXCP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3O/c1-11(6-3-4-9(11)12)10(15)8-5-7-13-14(8)2/h5,7,9H,3-4,6,12H2,1-2H3.
What are the key properties of (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone?
(2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone has a molecular weight of 207.28 g/mol, XLogP of 1.12, 2 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for (2-amino-1-methylcyclopentyl)-(2-methylpyrazol-3-yl)methanone is sourced from PubChem (CID 116607144), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).