1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine

C11H17N3 — CID 105445499

IUPAC1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine
SMILESCC(N)Cc1ncc2c(n1)CCCC2
InChIInChI=1S/C11H17N3/c1-8(12)6-11-13-7-9-4-2-3-5-10(9)14-11/h7-8H,2-6,12H2,1H3
InChIKeyIUQUMGGRKZJRKP-UHFFFAOYSA-N
MW191.28 g/mol
LogP1.25
Rot. Bonds2

About 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine

1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine (PubChem CID 105445499) has the molecular formula C11H17N3 and a molecular weight of 191.28 g/mol. Its IUPAC name is 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine.

Molecular Properties

Compound Name1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine
PubChem CID105445499
Molecular FormulaC11H17N3
Molecular Weight191.28 g/mol
Exact Mass191.14
IUPAC Name1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine
SMILESCC(N)Cc1ncc2c(n1)CCCC2
InChIInChI=1S/C11H17N3/c1-8(12)6-11-13-7-9-4-2-3-5-10(9)14-11/h7-8H,2-6,12H2,1H3
InChIKeyIUQUMGGRKZJRKP-UHFFFAOYSA-N
XLogP1.25
TPSA51.80 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500191.28
LogP ≤ 51.25
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5,6,7,8-tetrahydroquinazolin-2-ylmethanamine
CID 55265501
2-(2-aminopropyl)-5,6,7,8-tetrahydroquinazolin-4-amine
CID 105459542
2-(2-aminopropyl)-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-4-amine
CID 105476583
3-(6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-yl)propan-1-ol
CID 105459189
2-methyl-5-[2-(5,6,7,8-tetrahydroquinazolin-2-yl)ethyl]aniline
CID 82487373
2-phenyl-1-(5,6,7,8-tetrahydroquinazolin-2-yl)ethanamine
CID 82481824
4-[3-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-yl)propyl]aniline
CID 82481825
2-(6,7-dihydro-5H-cyclopenta[d]pyrimidin-2-ylmethyl)aniline
CID 82473451
2-tert-butyl-5,6,7,8-tetrahydroquinazoline
CID 18736797
trimethyl-[5,6,7,8-tetrahydroquinazolin-2-yl-(trimethyl-λ4-sulfanyl)methyl]-λ4-sulfane
CID 89375479
6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-ylhydrazine
CID 66490640
N-methyl-6,7,8,9-tetrahydro-5H-cyclohepta[d]pyrimidin-2-amine
CID 63549792

Frequently Asked Questions

What is the IUPAC name of 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine?
The IUPAC name of 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine (CID 105445499) is 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine.
What is the SMILES notation for 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine?
The canonical SMILES for 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine is CC(N)Cc1ncc2c(n1)CCCC2.
What is the InChIKey of 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine?
The InChIKey is IUQUMGGRKZJRKP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N3/c1-8(12)6-11-13-7-9-4-2-3-5-10(9)14-11/h7-8H,2-6,12H2,1H3.
What are the key properties of 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine?
1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine has a molecular weight of 191.28 g/mol, XLogP of 1.25, 2 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 1-(5,6,7,8-tetrahydroquinazolin-2-yl)propan-2-amine is sourced from PubChem (CID 105445499), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).