5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine

C10H16N4 — CID 80563182

IUPAC5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine
SMILESCc1cnc(NCC2CCNC2)nc1
InChIInChI=1S/C10H16N4/c1-8-4-12-10(13-5-8)14-7-9-2-3-11-6-9/h4-5,9,11H,2-3,6-7H2,1H3,(H,12,13,14)
InChIKeyLJBBYZRLJIOHAB-UHFFFAOYSA-N
MW192.27 g/mol
LogP0.81
Rot. Bonds3

About 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine

5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine (PubChem CID 80563182) has the molecular formula C10H16N4 and a molecular weight of 192.27 g/mol. Its IUPAC name is 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine.

Molecular Properties

Compound Name5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine
PubChem CID80563182
Molecular FormulaC10H16N4
Molecular Weight192.27 g/mol
Exact Mass192.14
IUPAC Name5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine
SMILESCc1cnc(NCC2CCNC2)nc1
InChIInChI=1S/C10H16N4/c1-8-4-12-10(13-5-8)14-7-9-2-3-11-6-9/h4-5,9,11H,2-3,6-7H2,1H3,(H,12,13,14)
InChIKeyLJBBYZRLJIOHAB-UHFFFAOYSA-N
XLogP0.81
TPSA49.84 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500192.27
LogP ≤ 50.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

5-methyl-N-(2-piperidin-4-ylethyl)pyrimidin-2-amine
CID 116975989
3-bromo-5-methyl-N-(pyrrolidin-3-ylmethyl)pyridin-2-amine
CID 105367397
5-methyl-N-(2-piperidin-3-ylethyl)pyrimidin-2-amine
CID 63630057
5-methoxy-N-(piperidin-3-ylmethyl)pyrimidin-2-amine
CID 114600875
5-methoxy-N-(piperidin-4-ylmethyl)pyrimidin-2-amine;dihydrochloride
CID 162422916
4-[5-(4-methylphenyl)-2-[[(3S)-pyrrolidin-3-yl]methylamino]pyrimidin-4-yl]benzonitrile
CID 118152103
4-chloro-5-methyl-N-(piperidin-3-ylmethyl)pyrimidin-2-amine;hydrochloride
CID 71639098
N-(pyrrolidin-3-ylmethyl)-1,3-oxazol-4-amine
CID 22560251
4-chloro-N-[[(3S)-pyrrolidin-3-yl]methyl]pyrimidin-2-amine
CID 97163818
2,3,5,6-tetramethyl-N-(pyrrolidin-3-ylmethyl)aniline
CID 115208554
6-methyl-N-[[(3S)-pyrrolidin-3-yl]methyl]pyridazin-3-amine
CID 96586619
4-[[(5-methylpyrimidin-2-yl)amino]methyl]cyclohexane-1-carboxylic acid
CID 79525747

Frequently Asked Questions

What is the IUPAC name of 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine?
The IUPAC name of 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine (CID 80563182) is 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine.
What is the SMILES notation for 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine?
The canonical SMILES for 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine is Cc1cnc(NCC2CCNC2)nc1.
What is the InChIKey of 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine?
The InChIKey is LJBBYZRLJIOHAB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H16N4/c1-8-4-12-10(13-5-8)14-7-9-2-3-11-6-9/h4-5,9,11H,2-3,6-7H2,1H3,(H,12,13,14).
What are the key properties of 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine?
5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine has a molecular weight of 192.27 g/mol, XLogP of 0.81, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 5-methyl-N-(pyrrolidin-3-ylmethyl)pyrimidin-2-amine is sourced from PubChem (CID 80563182), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).