N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine

C10H15N3 — CID 83846331

IUPACN-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine
SMILESCNCc1ncnc2c1CCCC2
InChIInChI=1S/C10H15N3/c1-11-6-10-8-4-2-3-5-9(8)12-7-13-10/h7,11H,2-6H2,1H3
InChIKeyMSMVEFQRJIEDKB-UHFFFAOYSA-N
MW177.25 g/mol
LogP1.07
Rot. Bonds2

About N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine

N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine (PubChem CID 83846331) has the molecular formula C10H15N3 and a molecular weight of 177.25 g/mol. Its IUPAC name is N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine.

Molecular Properties

Compound NameN-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine
PubChem CID83846331
Molecular FormulaC10H15N3
Molecular Weight177.25 g/mol
Exact Mass177.13
IUPAC NameN-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine
SMILESCNCc1ncnc2c1CCCC2
InChIInChI=1S/C10H15N3/c1-11-6-10-8-4-2-3-5-9(8)12-7-13-10/h7,11H,2-6H2,1H3
InChIKeyMSMVEFQRJIEDKB-UHFFFAOYSA-N
XLogP1.07
TPSA37.81 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500177.25
LogP ≤ 51.07
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

4-chloro-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidine
CID 63350898
N-(3-methylpentan-3-yl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 114174318
N'-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N,N'-dimethylethane-1,2-diamine
CID 62833182
N-methyl-1-(2-propan-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)methanamine
CID 83862303
5,6,7,8-tetrahydroquinazolin-4-amine
CID 45079028
N-methyl-2-(6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-ylamino)ethanesulfonamide
CID 102675424
4-propan-2-yl-6,7-dihydro-5H-cyclopenta[d]pyrimidine
CID 118338079
N-(2-chloro-3-methylbutyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 113492831
1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-yl)-N-ethyl-3-methoxypropan-2-amine
CID 63197261
1-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-4-ylamino)-2-methylpropan-2-ol
CID 63777387
1-(5-chloro-6-fluoropyrimidin-4-yl)-N-methylmethanamine
CID 163623613
N-methyl-1-(4,5,6,7-tetrahydro-1H-indazol-3-yl)methanamine
CID 3157469

Frequently Asked Questions

What is the IUPAC name of N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine?
The IUPAC name of N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine (CID 83846331) is N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine.
What is the SMILES notation for N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine?
The canonical SMILES for N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine is CNCc1ncnc2c1CCCC2.
What is the InChIKey of N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine?
The InChIKey is MSMVEFQRJIEDKB-UHFFFAOYSA-N. The full InChI is InChI=1S/C10H15N3/c1-11-6-10-8-4-2-3-5-9(8)12-7-13-10/h7,11H,2-6H2,1H3.
What are the key properties of N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine?
N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine has a molecular weight of 177.25 g/mol, XLogP of 1.07, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-1-(5,6,7,8-tetrahydroquinazolin-4-yl)methanamine is sourced from PubChem (CID 83846331), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).