N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide

C14H23N5O — CID 71807652

IUPACN-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide
SMILESCN(C)c1ncc(NC(=O)C2CCCC2)c(N(C)C)n1
InChIInChI=1S/C14H23N5O/c1-18(2)12-11(9-15-14(17-12)19(3)4)16-13(20)10-7-5-6-8-10/h9-10H,5-8H2,1-4H3,(H,16,20)
InChIKeyUDFZFCZMJVBQSE-UHFFFAOYSA-N
MW277.37 g/mol
LogP1.74
Rot. Bonds4

About N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide

N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide (PubChem CID 71807652) has the molecular formula C14H23N5O and a molecular weight of 277.37 g/mol. Its IUPAC name is N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide.

Molecular Properties

Compound NameN-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide
PubChem CID71807652
Molecular FormulaC14H23N5O
Molecular Weight277.37 g/mol
Exact Mass277.19
IUPAC NameN-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide
SMILESCN(C)c1ncc(NC(=O)C2CCCC2)c(N(C)C)n1
InChIInChI=1S/C14H23N5O/c1-18(2)12-11(9-15-14(17-12)19(3)4)16-13(20)10-7-5-6-8-10/h9-10H,5-8H2,1-4H3,(H,16,20)
InChIKeyUDFZFCZMJVBQSE-UHFFFAOYSA-N
XLogP1.74
TPSA61.36 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds4
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.37
LogP ≤ 51.74
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Frequently Asked Questions

What is the IUPAC name of N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide?
The IUPAC name of N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide (CID 71807652) is N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide.
What is the SMILES notation for N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide?
The canonical SMILES for N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide is CN(C)c1ncc(NC(=O)C2CCCC2)c(N(C)C)n1.
What is the InChIKey of N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide?
The InChIKey is UDFZFCZMJVBQSE-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H23N5O/c1-18(2)12-11(9-15-14(17-12)19(3)4)16-13(20)10-7-5-6-8-10/h9-10H,5-8H2,1-4H3,(H,16,20).
What are the key properties of N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide?
N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide has a molecular weight of 277.37 g/mol, XLogP of 1.74, 4 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2,4-bis(dimethylamino)pyrimidin-5-yl]cyclopentanecarboxamide is sourced from PubChem (CID 71807652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).