4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine

C15H23N3O — CID 56861658

IUPAC4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine
SMILESCN(CC1CCCO1)c1nccc(C2CCCC2)n1
InChIInChI=1S/C15H23N3O/c1-18(11-13-7-4-10-19-13)15-16-9-8-14(17-15)12-5-2-3-6-12/h8-9,12-13H,2-7,10-11H2,1H3
InChIKeyYRNJNHGZFOVGRF-UHFFFAOYSA-N
MW261.37 g/mol
LogP2.75
Rot. Bonds4

About 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine

4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine (PubChem CID 56861658) has the molecular formula C15H23N3O and a molecular weight of 261.37 g/mol. Its IUPAC name is 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine
PubChem CID56861658
Molecular FormulaC15H23N3O
Molecular Weight261.37 g/mol
Exact Mass261.18
IUPAC Name4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine
SMILESCN(CC1CCCO1)c1nccc(C2CCCC2)n1
InChIInChI=1S/C15H23N3O/c1-18(11-13-7-4-10-19-13)15-16-9-8-14(17-15)12-5-2-3-6-12/h8-9,12-13H,2-7,10-11H2,1H3
InChIKeyYRNJNHGZFOVGRF-UHFFFAOYSA-N
XLogP2.75
TPSA38.25 Ų
H-Bond Donors
H-Bond Acceptors4
Rotatable Bonds4
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.37
LogP ≤ 52.75
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 104

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Related Compounds

N-methyl-N-[[(2S)-oxan-2-yl]methyl]-4-pyridin-2-ylpyrimidin-2-amine
CID 97444786
N-methyl-N-(oxan-2-ylmethyl)-4-(trifluoromethyl)pyrimidin-2-amine
CID 133271752
N-methyl-N-(oxolan-2-ylmethyl)-4-(3,3,3-trifluoropropyl)pyrimidin-2-amine
CID 56878729
2-[methyl(oxolan-2-ylmethyl)amino]pyrimidine-4-carbothioamide
CID 107546808
2-N,4-N,5-trimethyl-2-N,4-N-bis[[(2R)-oxolan-2-yl]methyl]pyrimidine-2,4-diamine
CID 124859594
5-chloro-2-N,4-N-dimethyl-2-N,4-N-bis[[(2S)-oxan-2-yl]methyl]pyrimidine-2,4-diamine
CID 96526341
4-cyclopentyl-N-(oxan-2-ylmethyl)pyrimidin-2-amine
CID 56869794
5-bromo-2-N,4-N-dimethyl-2-N-[[(2S)-oxolan-2-yl]methyl]pyrimidine-2,4-diamine
CID 133498461
5-bromo-N,6-dimethyl-N-(oxan-2-ylmethyl)pyridin-2-amine
CID 103915128
3-bromo-N-methyl-N-(oxan-2-ylmethyl)pyridin-4-amine
CID 104778194
4-N-methyl-4-N-(oxolan-2-ylmethyl)quinoline-4,8-diamine
CID 83061179
[5-[methyl(oxolan-2-ylmethyl)amino]pyrazin-2-yl]methanol
CID 107372756

Frequently Asked Questions

What is the IUPAC name of 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine (CID 56861658) is 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine is CN(CC1CCCO1)c1nccc(C2CCCC2)n1.
What is the InChIKey of 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine?
The InChIKey is YRNJNHGZFOVGRF-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N3O/c1-18(11-13-7-4-10-19-13)15-16-9-8-14(17-15)12-5-2-3-6-12/h8-9,12-13H,2-7,10-11H2,1H3.
What are the key properties of 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine?
4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine has a molecular weight of 261.37 g/mol, XLogP of 2.75, 4 rotatable bonds, 0 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-cyclopentyl-N-methyl-N-(oxolan-2-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 56861658), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).