N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine

C15H20N4 — CID 64928662

IUPACN-[(2-aminocyclohexyl)methyl]quinazolin-4-amine
SMILESNC1CCCCC1CNc1ncnc2ccccc12
InChIInChI=1S/C15H20N4/c16-13-7-3-1-5-11(13)9-17-15-12-6-2-4-8-14(12)18-10-19-15/h2,4,6,8,10-11,13H,1,3,5,7,9,16H2,(H,17,18,19)
InChIKeyJXYUFUHIKRZMJV-UHFFFAOYSA-N
MW256.35 g/mol
LogP2.56
Rot. Bonds3

About N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine

N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine (PubChem CID 64928662) has the molecular formula C15H20N4 and a molecular weight of 256.35 g/mol. Its IUPAC name is N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine.

Molecular Properties

Compound NameN-[(2-aminocyclohexyl)methyl]quinazolin-4-amine
PubChem CID64928662
Molecular FormulaC15H20N4
Molecular Weight256.35 g/mol
Exact Mass256.17
IUPAC NameN-[(2-aminocyclohexyl)methyl]quinazolin-4-amine
SMILESNC1CCCCC1CNc1ncnc2ccccc12
InChIInChI=1S/C15H20N4/c16-13-7-3-1-5-11(13)9-17-15-12-6-2-4-8-14(12)18-10-19-15/h2,4,6,8,10-11,13H,1,3,5,7,9,16H2,(H,17,18,19)
InChIKeyJXYUFUHIKRZMJV-UHFFFAOYSA-N
XLogP2.56
TPSA63.83 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds3
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500256.35
LogP ≤ 52.56
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

4-[(quinazolin-4-ylamino)methyl]cyclohexan-1-ol
CID 106130913
(2S)-2-[(quinazolin-4-ylamino)methyl]piperidine-1-carboxylic acid
CID 67089806
N-[(2-aminocyclohexyl)methyl]quinoxalin-2-amine
CID 64926894
N-[(1-cyclopentylpyrazol-3-yl)methyl]quinazolin-4-amine
CID 133385979
quinazolin-4-ylthiourea
CID 22649288
N-[[(6R)-3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methyl]quinazolin-4-amine
CID 95764258
N-[[(6S)-3-ethyl-5,6,7,8-tetrahydro-[1,2,4]triazolo[4,3-a]pyridin-6-yl]methyl]quinazolin-4-amine
CID 95764257
N-[(2-aminocyclohexyl)methyl]pyridazin-3-amine
CID 64928861
N-[(1-methylcyclopentyl)methyl]quinazolin-4-amine
CID 55261394
N-(6,7-dihydro-5H-pyrrolo[2,1-c][1,2,4]triazol-3-ylmethyl)quinazolin-4-amine
CID 24607035
1-pyrrolidin-1-yl-3-(quinazolin-4-ylamino)propan-1-one
CID 47121012
N-[2-(1-methylpiperidin-4-yl)ethyl]quinazolin-4-amine
CID 115599555

Frequently Asked Questions

What is the IUPAC name of N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine?
The IUPAC name of N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine (CID 64928662) is N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine.
What is the SMILES notation for N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine?
The canonical SMILES for N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine is NC1CCCCC1CNc1ncnc2ccccc12.
What is the InChIKey of N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine?
The InChIKey is JXYUFUHIKRZMJV-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H20N4/c16-13-7-3-1-5-11(13)9-17-15-12-6-2-4-8-14(12)18-10-19-15/h2,4,6,8,10-11,13H,1,3,5,7,9,16H2,(H,17,18,19).
What are the key properties of N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine?
N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine has a molecular weight of 256.35 g/mol, XLogP of 2.56, 3 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-[(2-aminocyclohexyl)methyl]quinazolin-4-amine is sourced from PubChem (CID 64928662), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).