N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide

C14H23N5O — CID 109249531

IUPACN-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide
SMILESCN(C)CCNc1ncc(C(=O)NC2CCCC2)cn1
InChIInChI=1S/C14H23N5O/c1-19(2)8-7-15-14-16-9-11(10-17-14)13(20)18-12-5-3-4-6-12/h9-10,12H,3-8H2,1-2H3,(H,18,20)(H,15,16,17)
InChIKeyQKAUOCFBKMZJDH-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.12
Rot. Bonds6

About N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide

N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide (PubChem CID 109249531) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide.

Molecular Properties

Compound NameN-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide
PubChem CID109249531
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide
SMILESCN(C)CCNc1ncc(C(=O)NC2CCCC2)cn1
InChIInChI=1S/C14H23N5O/c1-19(2)8-7-15-14-16-9-11(10-17-14)13(20)18-12-5-3-4-6-12/h9-10,12H,3-8H2,1-2H3,(H,18,20)(H,15,16,17)
InChIKeyQKAUOCFBKMZJDH-UHFFFAOYSA-N
XLogP1.12
TPSA70.15 Ų
H-Bond Donors2
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.12
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 105

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Related Compounds

2-[2-(dimethylamino)ethylamino]-N-(1,1-dioxothiolan-3-yl)pyrimidine-5-carboxamide
CID 109252887
N-cyclohexyl-2-(2-methoxyethylamino)pyrimidine-5-carboxamide
CID 109250278
2-[2-(dimethylamino)ethylamino]-N-[3-(dimethylamino)propyl]pyrimidine-5-carboxamide
CID 109252856
2-(tert-butylamino)-N-cyclopentylpyrimidine-5-carboxamide
CID 109249591
N-cyclopentyl-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109249542
N-cycloheptyl-2-(dipropylamino)pyrimidine-5-carboxamide
CID 109263085
N-cycloheptyl-2-[(4-methylphenyl)methylamino]pyrimidine-5-carboxamide
CID 109256246
4-N-cycloheptyl-1-N-[2-(dimethylamino)ethyl]benzene-1,4-dicarboxamide
CID 109045756
N-butan-2-yl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide
CID 109248829
2-(cycloheptylamino)-N-[3-(dimethylamino)propyl]pyrimidine-5-carboxamide
CID 109253363
N-cyclohexyl-2-[2-(4-methoxyphenyl)ethylamino]pyrimidine-5-carboxamide
CID 109250312
N-[2-(dimethylamino)ethyl]-2-(2-methoxyethylamino)pyrimidine-5-carboxamide
CID 109251488

Frequently Asked Questions

What is the IUPAC name of N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide?
The IUPAC name of N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide (CID 109249531) is N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide.
What is the SMILES notation for N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide?
The canonical SMILES for N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide is CN(C)CCNc1ncc(C(=O)NC2CCCC2)cn1.
What is the InChIKey of N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide?
The InChIKey is QKAUOCFBKMZJDH-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-19(2)8-7-15-14-16-9-11(10-17-14)13(20)18-12-5-3-4-6-12/h9-10,12H,3-8H2,1-2H3,(H,18,20)(H,15,16,17).
What are the key properties of N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide?
N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.12, 6 rotatable bonds, 2 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopentyl-2-[2-(dimethylamino)ethylamino]pyrimidine-5-carboxamide is sourced from PubChem (CID 109249531), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).