N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine

C14H25N5 — CID 105416018

IUPACN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine
SMILESCNCc1cnc(N(C)CC2(N(C)C)CCC2)nc1
InChIInChI=1S/C14H25N5/c1-15-8-12-9-16-13(17-10-12)19(4)11-14(18(2)3)6-5-7-14/h9-10,15H,5-8,11H2,1-4H3
InChIKeyLPJOWVVPLGZGNY-UHFFFAOYSA-N
MW263.39 g/mol
LogP1.12
Rot. Bonds6

About N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine

N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine (PubChem CID 105416018) has the molecular formula C14H25N5 and a molecular weight of 263.39 g/mol. Its IUPAC name is N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine.

Molecular Properties

Compound NameN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine
PubChem CID105416018
Molecular FormulaC14H25N5
Molecular Weight263.39 g/mol
Exact Mass263.21
IUPAC NameN-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine
SMILESCNCc1cnc(N(C)CC2(N(C)C)CCC2)nc1
InChIInChI=1S/C14H25N5/c1-15-8-12-9-16-13(17-10-12)19(4)11-14(18(2)3)6-5-7-14/h9-10,15H,5-8,11H2,1-4H3
InChIKeyLPJOWVVPLGZGNY-UHFFFAOYSA-N
XLogP1.12
TPSA44.29 Ų
H-Bond Donors1
H-Bond Acceptors5
Rotatable Bonds6
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.39
LogP ≤ 51.12
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 105

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Related Compounds

4-N-(2,2-dimethylpropyl)-5-methylpyrimidine-2,4-diamine
CID 80798438
Methyl[(pyrimidin-5-yl)methyl]amine
CID 20607229
N,N-dimethyl-5-((methylamino)methyl)pyrimidin-2-amine
CID 62756582
5-{[(2-Azepan-1-ylethyl)(methyl)amino]methyl}pyrimidin-2-amine
CID 56717353
5-methyl-N-[2-methyl-2-(4-methylpiperazin-1-yl)propyl]pyrimidin-2-amine
CID 72859157
5-{[rel-(3R,4S)-3-amino-4-cyclopropyl-1-pyrrolidinyl]methyl}-N-ethyl-2-pyrimidinamine dihydrochloride
CID 72860282
5-ethyl-N~4~-(2-piperidin-1-ylethyl)pyrimidine-2,4-diamine
CID 72922646
5-methyl-N-(2-methyl-2-piperidin-1-ylpropyl)pyrimidin-2-amine
CID 72928341
N-methyl-5-[[methyl(2-piperidin-1-ylethyl)amino]methyl]pyrimidin-2-amine
CID 73945372
N-methyl-5-[[methyl-(1-propan-2-ylpiperidin-4-yl)amino]methyl]pyrimidin-2-amine
CID 95857554
5-Methyl-2-(piperazin-1-yl)pyrimidine dihydrochloride
CID 86276657
N,N-dimethyl-5-((methylamino)methyl)pyrimidin-2-amine dihydrochloride
CID 146049995

Frequently Asked Questions

What is the IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The IUPAC name of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine (CID 105416018) is N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine.
What is the SMILES notation for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The canonical SMILES for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine is CNCc1cnc(N(C)CC2(N(C)C)CCC2)nc1.
What is the InChIKey of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
The InChIKey is LPJOWVVPLGZGNY-UHFFFAOYSA-N. The full InChI is InChI=1S/C14H25N5/c1-15-8-12-9-16-13(17-10-12)19(4)11-14(18(2)3)6-5-7-14/h9-10,15H,5-8,11H2,1-4H3.
What are the key properties of N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine?
N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine has a molecular weight of 263.39 g/mol, XLogP of 1.12, 6 rotatable bonds, 1 hydrogen bond donors, and 5 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[1-(dimethylamino)cyclobutyl]methyl]-N-methyl-5-(methylaminomethyl)pyrimidin-2-amine is sourced from PubChem (CID 105416018), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).