[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea

C15H23N5O — CID 133461617

IUPAC[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea
SMILESCc1nc2c(c(N3CCC(NC(N)=O)CC3)n1)CCCC2
InChIInChI=1S/C15H23N5O/c1-10-17-13-5-3-2-4-12(13)14(18-10)20-8-6-11(7-9-20)19-15(16)21/h11H,2-9H2,1H3,(H3,16,19,21)
InChIKeyADMJZBPCKOUGSB-UHFFFAOYSA-N
MW289.38 g/mol
LogP1.30
Rot. Bonds2

About [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea

[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea (PubChem CID 133461617) has the molecular formula C15H23N5O and a molecular weight of 289.38 g/mol. Its IUPAC name is [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea.

Molecular Properties

Compound Name[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea
PubChem CID133461617
Molecular FormulaC15H23N5O
Molecular Weight289.38 g/mol
Exact Mass289.19
IUPAC Name[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea
SMILESCc1nc2c(c(N3CCC(NC(N)=O)CC3)n1)CCCC2
InChIInChI=1S/C15H23N5O/c1-10-17-13-5-3-2-4-12(13)14(18-10)20-8-6-11(7-9-20)19-15(16)21/h11H,2-9H2,1H3,(H3,16,19,21)
InChIKeyADMJZBPCKOUGSB-UHFFFAOYSA-N
XLogP1.30
TPSA84.14 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds2
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500289.38
LogP ≤ 51.30
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

Analyze [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea with MolForge

Explore ADMET properties, 3D molecular structure, drug-likeness score, and discover similar compounds using our AI-powered platform.

Launch Full Analysis

Related Compounds

5-chloro-N-[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]thiophene-2-carboxamide
CID 91631760
1-[(4-fluorophenyl)methyl]-3-[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea
CID 91817882
tert-butyl N-[(3S)-1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)pyrrolidin-3-yl]carbamate
CID 133472766
(E)-N-[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]-3-pyridin-3-ylprop-2-enamide
CID 117055199
N-[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]-2-phenyltriazole-4-carboxamide
CID 91631721
2-methyl-4-[4-(trifluoromethyl)piperidin-1-yl]-5,6,7,8-tetrahydroquinazoline
CID 133461386
1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidine-3-carboxylic acid
CID 102549336
N-[(3S)-1-(2-amino-5,6,7,8-tetrahydroquinazolin-4-yl)pyrrolidin-3-yl]acetamide
CID 97198298
ethyl (3S)-1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidine-3-carboxylate
CID 133472617
(4R)-N,N-dimethyl-1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)azepan-4-amine
CID 124744132
2-methyl-4-pyrrolidin-1-yl-5,6,7,8-tetrahydroquinazoline;propane
CID 143604667
N-cyclohexyl-2-methyl-4-(4-methylpiperidin-1-yl)-7,8-dihydro-5H-pyrido[4,3-d]pyrimidine-6-carboxamide
CID 42788673

Frequently Asked Questions

What is the IUPAC name of [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea?
The IUPAC name of [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea (CID 133461617) is [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea.
What is the SMILES notation for [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea?
The canonical SMILES for [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea is Cc1nc2c(c(N3CCC(NC(N)=O)CC3)n1)CCCC2.
What is the InChIKey of [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea?
The InChIKey is ADMJZBPCKOUGSB-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H23N5O/c1-10-17-13-5-3-2-4-12(13)14(18-10)20-8-6-11(7-9-20)19-15(16)21/h11H,2-9H2,1H3,(H3,16,19,21).
What are the key properties of [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea?
[1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea has a molecular weight of 289.38 g/mol, XLogP of 1.30, 2 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for [1-(2-methyl-5,6,7,8-tetrahydroquinazolin-4-yl)piperidin-4-yl]urea is sourced from PubChem (CID 133461617), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).