6-tert-butyl-N-cyclopropylpyrimidin-4-amine

C11H17N3 — CID 126849020

IUPAC6-tert-butyl-N-cyclopropylpyrimidin-4-amine
SMILESCC(C)(C)c1cc(NC2CC2)ncn1
InChIInChI=1S/C11H17N3/c1-11(2,3)9-6-10(13-7-12-9)14-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyWDUSGVQZNAQBDC-UHFFFAOYSA-N
MW191.28 g/mol
LogP2.35
Rot. Bonds2

About 6-tert-butyl-N-cyclopropylpyrimidin-4-amine

6-tert-butyl-N-cyclopropylpyrimidin-4-amine (PubChem CID 126849020) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 6-tert-butyl-N-cyclopropylpyrimidin-4-amine.

Molecular Properties

Compound Name6-tert-butyl-N-cyclopropylpyrimidin-4-amine
PubChem CID126849020
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name6-tert-butyl-N-cyclopropylpyrimidin-4-amine
SMILESCC(C)(C)c1cc(NC2CC2)ncn1
InChIInChI=1S/C11H17N3/c1-11(2,3)9-6-10(13-7-12-9)14-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,12,13,14)
InChIKeyWDUSGVQZNAQBDC-UHFFFAOYSA-N
XLogP2.35
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 52.35
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-[(6-tert-butylpyrimidin-4-yl)amino]-N-methylcyclohexane-1-carboxamide
CID 126724613
6-tert-butyl-N-[(3S)-oxolan-3-yl]pyrimidin-4-amine
CID 126724583
[3-[(6-tert-butylpyrimidin-4-yl)amino]azetidin-1-yl]-cyclobutylmethanone
CID 118546922
6-N-cyclohexyl-4-N-cyclopropylpyrimidine-4,6-diamine
CID 112854680
4-N-cyclopropyl-6-N-propylpyrimidine-4,6-diamine
CID 80769657
N-cyclobutyl-6-methylpyrimidin-4-amine
CID 62416944
4-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]cyclohexan-1-ol
CID 115265146
4-N-cyclopropyl-6-N-[2-(dimethylamino)ethyl]pyrimidine-4,6-diamine
CID 112854687
4-N-cyclopropyl-6-N-(2,4-dimethylphenyl)pyrimidine-4,6-diamine
CID 112854769
4-N-cyclopropyl-6-N-[3-(dimethylamino)propyl]pyrimidine-4,6-diamine
CID 112854689
2-[[6-(cyclobutylamino)pyrimidin-4-yl]amino]-2-methylpropanoic acid
CID 115264300
6-N-cyclopentyl-4-N,4-N-dimethylpyrimidine-4,6-diamine
CID 122281906

Frequently Asked Questions

What is the IUPAC name of 6-tert-butyl-N-cyclopropylpyrimidin-4-amine?
The IUPAC name of 6-tert-butyl-N-cyclopropylpyrimidin-4-amine (CID 126849020) is 6-tert-butyl-N-cyclopropylpyrimidin-4-amine.
What is the SMILES notation for 6-tert-butyl-N-cyclopropylpyrimidin-4-amine?
The canonical SMILES for 6-tert-butyl-N-cyclopropylpyrimidin-4-amine is CC(C)(C)c1cc(NC2CC2)ncn1.
What is the InChIKey of 6-tert-butyl-N-cyclopropylpyrimidin-4-amine?
The InChIKey is WDUSGVQZNAQBDC-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-11(2,3)9-6-10(13-7-12-9)14-8-4-5-8/h6-8H,4-5H2,1-3H3,(H,12,13,14).
What are the key properties of 6-tert-butyl-N-cyclopropylpyrimidin-4-amine?
6-tert-butyl-N-cyclopropylpyrimidin-4-amine has a molecular weight of 191.28 g/mol, XLogP of 2.35, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-tert-butyl-N-cyclopropylpyrimidin-4-amine is sourced from PubChem (CID 126849020), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).