5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine

C14H22N4 — CID 83186265

IUPAC5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine
SMILESCc1nc(N(CC2CC2)CC2CC2)ncc1CN
InChIInChI=1S/C14H22N4/c1-10-13(6-15)7-16-14(17-10)18(8-11-2-3-11)9-12-4-5-12/h7,11-12H,2-6,8-9,15H2,1H3
InChIKeyROIGMTYIRAEWPY-UHFFFAOYSA-N
MW246.36 g/mol
LogP1.87
Rot. Bonds6

About 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine

5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine (PubChem CID 83186265) has the molecular formula C14H22N4 and a molecular weight of 246.36 g/mol. Its IUPAC name is 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine.

Molecular Properties

Compound Name5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine
PubChem CID83186265
Molecular FormulaC14H22N4
Molecular Weight246.36 g/mol
Exact Mass246.18
IUPAC Name5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine
SMILESCc1nc(N(CC2CC2)CC2CC2)ncc1CN
InChIInChI=1S/C14H22N4/c1-10-13(6-15)7-16-14(17-10)18(8-11-2-3-11)9-12-4-5-12/h7,11-12H,2-6,8-9,15H2,1H3
InChIKeyROIGMTYIRAEWPY-UHFFFAOYSA-N
XLogP1.87
TPSA55.04 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms18
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500246.36
LogP ≤ 51.87
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-(cyclopropylmethyl)-4-methyl-N-propyl-5-(propylaminomethyl)pyrimidin-2-amine
CID 83186228
5-(aminomethyl)-N-cyclopropyl-4-methyl-N-(2-methylpropyl)pyrimidin-2-amine
CID 83185973
5-(aminomethyl)-N,4-dimethyl-N-propan-2-ylpyrimidin-2-amine
CID 83185143
5-(aminomethyl)-N-cyclopentyl-4-methyl-N-(3-methylbutyl)pyrimidin-2-amine
CID 83189626
5-(aminomethyl)-N-(cyclobutylmethyl)-N-ethyl-2-methylpyrimidin-4-amine
CID 114216694
5-(aminomethyl)-N,4-dimethyl-N-(3-methylbutan-2-yl)pyrimidin-2-amine
CID 83186214
N-(cyclobutylmethyl)-N-ethyl-4-methyl-5-[(2-methylpropylamino)methyl]pyrimidin-2-amine
CID 107401794
2-N,2-N-bis(cyclopropylmethyl)pyrimidine-2,4-diamine
CID 116796967
5-(aminomethyl)-4-methyl-N-(2-methylpropyl)-N-propan-2-ylpyrimidin-2-amine
CID 83185816
N-cyclopropyl-N-(cyclopropylmethyl)-5-(ethylaminomethyl)-4-methylpyrimidin-2-amine
CID 83189085
[2-[cyclohexylmethyl(methyl)amino]-4-methylpyrimidin-5-yl]methanol
CID 83184195
[2-(3,4-dimethylcyclohexyl)oxy-4-methylpyrimidin-5-yl]methanamine
CID 83189230

Frequently Asked Questions

What is the IUPAC name of 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine?
The IUPAC name of 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine (CID 83186265) is 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine.
What is the SMILES notation for 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine?
The canonical SMILES for 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine is Cc1nc(N(CC2CC2)CC2CC2)ncc1CN.
What is the InChIKey of 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine?
The InChIKey is ROIGMTYIRAEWPY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H22N4/c1-10-13(6-15)7-16-14(17-10)18(8-11-2-3-11)9-12-4-5-12/h7,11-12H,2-6,8-9,15H2,1H3.
What are the key properties of 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine?
5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine has a molecular weight of 246.36 g/mol, XLogP of 1.87, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-(aminomethyl)-N,N-bis(cyclopropylmethyl)-4-methylpyrimidin-2-amine is sourced from PubChem (CID 83186265), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).