2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide

C13H21N3OS — CID 82763796

IUPAC2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide
SMILESCc1ncc(CN(C)C(=O)C2(C)CCCC2N)s1
InChIInChI=1S/C13H21N3OS/c1-9-15-7-10(18-9)8-16(3)12(17)13(2)6-4-5-11(13)14/h7,11H,4-6,8,14H2,1-3H3
InChIKeyJTQPIKJFDADVHQ-UHFFFAOYSA-N
MW267.40 g/mol
LogP1.93
Rot. Bonds3

About 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide

2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide (PubChem CID 82763796) has the molecular formula C13H21N3OS and a molecular weight of 267.40 g/mol. Its IUPAC name is 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide.

Molecular Properties

Compound Name2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide
PubChem CID82763796
Molecular FormulaC13H21N3OS
Molecular Weight267.40 g/mol
Exact Mass267.14
IUPAC Name2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide
SMILESCc1ncc(CN(C)C(=O)C2(C)CCCC2N)s1
InChIInChI=1S/C13H21N3OS/c1-9-15-7-10(18-9)8-16(3)12(17)13(2)6-4-5-11(13)14/h7,11H,4-6,8,14H2,1-3H3
InChIKeyJTQPIKJFDADVHQ-UHFFFAOYSA-N
XLogP1.93
TPSA59.22 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500267.40
LogP ≤ 51.93
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide?
The IUPAC name of 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide (CID 82763796) is 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide.
What is the SMILES notation for 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide?
The canonical SMILES for 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide is Cc1ncc(CN(C)C(=O)C2(C)CCCC2N)s1.
What is the InChIKey of 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide?
The InChIKey is JTQPIKJFDADVHQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H21N3OS/c1-9-15-7-10(18-9)8-16(3)12(17)13(2)6-4-5-11(13)14/h7,11H,4-6,8,14H2,1-3H3.
What are the key properties of 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide?
2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide has a molecular weight of 267.40 g/mol, XLogP of 1.93, 3 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 2-amino-N,1-dimethyl-N-[(2-methyl-1,3-thiazol-5-yl)methyl]cyclopentane-1-carboxamide is sourced from PubChem (CID 82763796), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).