6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine

C15H25N3 — CID 79363066

IUPAC6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
SMILESCCCc1cc(NCC2C(C)(C)C2(C)C)ncn1
InChIInChI=1S/C15H25N3/c1-6-7-11-8-13(18-10-17-11)16-9-12-14(2,3)15(12,4)5/h8,10,12H,6-7,9H2,1-5H3,(H,16,17,18)
InChIKeyFTBCNMYTPRKJLT-UHFFFAOYSA-N
MW247.39 g/mol
LogP3.52
Rot. Bonds5

About 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine

6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine (PubChem CID 79363066) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine.

Molecular Properties

Compound Name6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
PubChem CID79363066
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC Name6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine
SMILESCCCc1cc(NCC2C(C)(C)C2(C)C)ncn1
InChIInChI=1S/C15H25N3/c1-6-7-11-8-13(18-10-17-11)16-9-12-14(2,3)15(12,4)5/h8,10,12H,6-7,9H2,1-5H3,(H,16,17,18)
InChIKeyFTBCNMYTPRKJLT-UHFFFAOYSA-N
XLogP3.52
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 53.52
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclobutylmethyl)-6-propylpyrimidin-4-amine
CID 61241873
N-ethyl-N'-(6-propylpyrimidin-4-yl)propane-1,3-diamine
CID 61241880
N-(2-methylbutyl)-6-propylpyrimidin-4-amine
CID 62694370
N-(3-cyclopentylpropyl)-6-propylpyrimidin-4-amine
CID 106012599
N-[(4-methyloxan-4-yl)methyl]-6-propylpyrimidin-4-amine
CID 114125912
1-N-(6-propylpyrimidin-4-yl)butane-1,3-diamine
CID 63251185
N-(2-methoxy-2-methylpropyl)-6-propylpyrimidin-4-amine
CID 104762532
N-[(1,4-dimethylpiperidin-4-yl)methyl]-6-propylpyrimidin-4-amine
CID 107164291
N-(2-cyclopentylethyl)-6-propylpyrimidin-4-amine
CID 61241874
1-[[(6-propylpyrimidin-4-yl)amino]methyl]cyclohexan-1-ol
CID 65110996
N-(2-phenylethyl)-6-propylpyrimidin-4-amine
CID 61240140
methyl 2-[(6-propylpyrimidin-4-yl)amino]acetate
CID 61240139

Frequently Asked Questions

What is the IUPAC name of 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine?
The IUPAC name of 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine (CID 79363066) is 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine.
What is the SMILES notation for 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine?
The canonical SMILES for 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine is CCCc1cc(NCC2C(C)(C)C2(C)C)ncn1.
What is the InChIKey of 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine?
The InChIKey is FTBCNMYTPRKJLT-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-6-7-11-8-13(18-10-17-11)16-9-12-14(2,3)15(12,4)5/h8,10,12H,6-7,9H2,1-5H3,(H,16,17,18).
What are the key properties of 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine?
6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine has a molecular weight of 247.39 g/mol, XLogP of 3.52, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-propyl-N-[(2,2,3,3-tetramethylcyclopropyl)methyl]pyrimidin-4-amine is sourced from PubChem (CID 79363066), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).