4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine

C11H11ClN4 — CID 105495563

IUPAC4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine
SMILESNc1nc(C2(N)CC2)c2cc(Cl)ccc2n1
InChIInChI=1S/C11H11ClN4/c12-6-1-2-8-7(5-6)9(11(14)3-4-11)16-10(13)15-8/h1-2,5H,3-4,14H2,(H2,13,15,16)
InChIKeySRPIDPZAOLFJLP-UHFFFAOYSA-N
MW234.69 g/mol
LogP1.81
Rot. Bonds1

About 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine

4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine (PubChem CID 105495563) has the molecular formula C11H11ClN4 and a molecular weight of 234.69 g/mol. Its IUPAC name is 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine.

Molecular Properties

Compound Name4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine
PubChem CID105495563
Molecular FormulaC11H11ClN4
Molecular Weight234.69 g/mol
Exact Mass234.07
IUPAC Name4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine
SMILESNc1nc(C2(N)CC2)c2cc(Cl)ccc2n1
InChIInChI=1S/C11H11ClN4/c12-6-1-2-8-7(5-6)9(11(14)3-4-11)16-10(13)15-8/h1-2,5H,3-4,14H2,(H2,13,15,16)
InChIKeySRPIDPZAOLFJLP-UHFFFAOYSA-N
XLogP1.81
TPSA77.82 Ų
H-Bond Donors2
H-Bond Acceptors4
Rotatable Bonds1
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500234.69
LogP ≤ 51.81
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 104

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Related Compounds

6-chloro-4-cyclopropylquinazolin-2-amine
CID 105475079
1-(7-chloroquinazolin-4-yl)cyclopropan-1-amine
CID 105475082
1-(6-chloroquinazolin-2-yl)cyclopropan-1-amine;dihydrochloride
CID 141236937
3,6-dichloro-2-methylquinolin-4-amine
CID 121236621
6-chloro-2-cyclopropylquinazolin-4-amine
CID 106583780
1-(5-chloro-1,3-benzothiazol-2-yl)cyclopropan-1-amine
CID 65465187
1-(6-chloronaphthalen-2-yl)cyclopropan-1-amine
CID 105471892
6-chloro-2-(1,1,2,2,2-pentafluoroethyl)quinazolin-4-amine
CID 64983527
1-(6-chloro-1,3-benzothiazol-2-yl)cyclopentan-1-amine
CID 79527764
1-(6-chloro-1,3-benzoxazol-2-yl)cyclohexan-1-amine
CID 81433944
1-(2-chloroquinolin-4-yl)cyclopropan-1-amine
CID 171792050
4-amino-6-chloroquinoline-2-carboxylic acid
CID 46398171

Frequently Asked Questions

What is the IUPAC name of 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine?
The IUPAC name of 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine (CID 105495563) is 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine.
What is the SMILES notation for 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine?
The canonical SMILES for 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine is Nc1nc(C2(N)CC2)c2cc(Cl)ccc2n1.
What is the InChIKey of 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine?
The InChIKey is SRPIDPZAOLFJLP-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H11ClN4/c12-6-1-2-8-7(5-6)9(11(14)3-4-11)16-10(13)15-8/h1-2,5H,3-4,14H2,(H2,13,15,16).
What are the key properties of 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine?
4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine has a molecular weight of 234.69 g/mol, XLogP of 1.81, 1 rotatable bonds, 2 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 4-(1-aminocyclopropyl)-6-chloroquinazolin-2-amine is sourced from PubChem (CID 105495563), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).