6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine

C10H15N3 — CID 131071652

IUPAC6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine
SMILESC=C(CC)CNc1cc(C)ncn1
InChIInChI=1S/C10H15N3/c1-4-8(2)6-11-10-5-9(3)12-7-13-10/h5,7H,2,4,6H2,1,3H3,(H,11,12,13)
InChIKeyVZYWTIZMKRHOQF-UHFFFAOYSA-N
MW177.25 g/mol
LogP2.16
Rot. Bonds4

About 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine

6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine (PubChem CID 131071652) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine.

Molecular Properties

Compound Name6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine
PubChem CID131071652
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC Name6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine
SMILESC=C(CC)CNc1cc(C)ncn1
InChIInChI=1S/C10H15N3/c1-4-8(2)6-11-10-5-9(3)12-7-13-10/h5,7H,2,4,6H2,1,3H3,(H,11,12,13)
InChIKeyVZYWTIZMKRHOQF-UHFFFAOYSA-N
XLogP2.16
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 52.16
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'isolated_alkene', 'substructure': 'N/A'}

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Related Compounds

6-bromo-N-(2-methylidenebutyl)pyrimidin-4-amine
CID 131054209
5-bromo-4-methyl-N-(2-methylidenebutyl)pyridin-2-amine
CID 130655433
N-tert-butyl-2-[(6-methylpyrimidin-4-yl)amino]acetamide
CID 78954650
6-methyl-N-(2,2,3-trimethylbutyl)pyrimidin-4-amine
CID 102609023
1-[(6-methylpyrimidin-4-yl)amino]propan-2-ol
CID 61226295
N-(2-bromoethyl)-6-methylpyrimidin-4-amine
CID 126848039
N-(2-methylidenebutyl)pyridin-2-amine
CID 131093254
N-(2-methoxy-2-methylpropyl)-6-methylpyrimidin-4-amine
CID 115658439
2-methyl-2-[(6-methylpyrimidin-4-yl)amino]butan-1-ol
CID 64558196
2-[(6-methylpyrimidin-4-yl)amino]ethylurea
CID 79033984
N-(3-bromopropyl)-6-methylpyrimidin-4-amine
CID 126848040
N',N'-dimethyl-N-(6-methylpyrimidin-4-yl)ethane-1,2-diamine
CID 61225693

Frequently Asked Questions

What is the IUPAC name of 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine?
The IUPAC name of 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine (CID 131071652) is 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine.
What is the SMILES notation for 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine?
The canonical SMILES for 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine is C=C(CC)CNc1cc(C)ncn1.
What is the InChIKey of 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine?
The InChIKey is VZYWTIZMKRHOQF-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-4-8(2)6-11-10-5-9(3)12-7-13-10/h5,7H,2,4,6H2,1,3H3,(H,11,12,13).
What are the key properties of 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine?
6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine has a molecular weight of 177.25 g/mol, XLogP of 2.16, 4 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 6-methyl-N-(2-methylidenebutyl)pyrimidin-4-amine is sourced from PubChem (CID 131071652), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).