cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol

C10H15N3O — CID 130643849

IUPACcis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol
SMILESCc1cc(N[C@H]2CC[C@@H](O)C2)ncn1
InChIInChI=1S/C10H15N3O/c1-7-4-10(12-6-11-7)13-8-2-3-9(14)5-8/h4,6,8-9,14H,2-3,5H2,1H3,(H,11,12,13)/t8-,9+/m0/s1
InChIKeyBPKVEGYVPVMNLK-DTWKUNHWSA-N
MW193.25 g/mol
LogP1.11
Rot. Bonds2

About cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol

cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol (PubChem CID 130643849) has the molecular formula C10H15N3O and a molecular weight of 193.25 g/mol. Its IUPAC name is cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol.

Molecular Properties

Compound Namecis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol
PubChem CID130643849
Molecular FormulaC10H15N3O
Molecular Weight193.25 g/mol
Exact Mass193.12
IUPAC Namecis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol
SMILESCc1cc(N[C@H]2CC[C@@H](O)C2)ncn1
InChIInChI=1S/C10H15N3O/c1-7-4-10(12-6-11-7)13-8-2-3-9(14)5-8/h4,6,8-9,14H,2-3,5H2,1H3,(H,11,12,13)/t8-,9+/m0/s1
InChIKeyBPKVEGYVPVMNLK-DTWKUNHWSA-N
XLogP1.11
TPSA58.04 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.25
LogP ≤ 51.11
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

N-cyclobutyl-6-methylpyrimidin-4-amine
CID 62416944
N-(3,5-dimethylcyclohexyl)-6-methylpyrimidin-4-amine
CID 64723771
4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 115265146
N-(3-methoxycyclohexyl)-6-methylpyrimidin-4-amine
CID 133399476
(1S,2S,4R)-2-(hydroxymethyl)-4-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol
CID 59671218
N-(1,2-dimethylpiperidin-4-yl)-6-methylpyrimidin-4-amine
CID 79033350
1-N-(6-methylpyrimidin-4-yl)cyclopropane-1,2-diamine
CID 61226903
6-methyl-N-(2-methyloxolan-3-yl)pyrimidin-4-amine
CID 82728623
N-methyl-N-[4-[(6-methylpyrimidin-4-yl)amino]cyclohexyl]acetamide
CID 90245746
4-[(6-bromopyrimidin-4-yl)amino]cyclohexan-1-ol
CID 104966810
4-[(6-fluoropyrimidin-4-yl)amino]cyclohexan-1-ol
CID 104966807
6-methyl-N-(2-oxaspiro[3.3]heptan-6-yl)pyrimidin-4-amine
CID 90249167

Frequently Asked Questions

What is the IUPAC name of cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol?
The IUPAC name of cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol (CID 130643849) is cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol.
What is the SMILES notation for cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol?
The canonical SMILES for cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol is Cc1cc(N[C@H]2CC[C@@H](O)C2)ncn1.
What is the InChIKey of cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol?
The InChIKey is BPKVEGYVPVMNLK-DTWKUNHWSA-N. The full InChI is InChI=1S/C10H15N3O/c1-7-4-10(12-6-11-7)13-8-2-3-9(14)5-8/h4,6,8-9,14H,2-3,5H2,1H3,(H,11,12,13)/t8-,9+/m0/s1.
What are the key properties of cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol?
cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol has a molecular weight of 193.25 g/mol, XLogP of 1.11, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for cis-(1R,3S)-3-[(6-methylpyrimidin-4-yl)amino]cyclopentan-1-ol is sourced from PubChem (CID 130643849), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).