(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine

C19H26N2 — CID 105379767

IUPAC(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine
SMILESCC/C(=C/c1ccc2nc(C)ccc2c1)CNC(C)(C)C
InChIInChI=1S/C19H26N2/c1-6-15(13-20-19(3,4)5)11-16-8-10-18-17(12-16)9-7-14(2)21-18/h7-12,20H,6,13H2,1-5H3/b15-11-
InChIKeyOFXUZBZLFCDPGJ-PTNGSMBKSA-N
MW282.43 g/mol
LogP4.72
Rot. Bonds4

About (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine

(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine (PubChem CID 105379767) has the molecular formula C19H26N2 and a molecular weight of 282.43 g/mol. Its IUPAC name is (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine.

Molecular Properties

Compound Name(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine
PubChem CID105379767
Molecular FormulaC19H26N2
Molecular Weight282.43 g/mol
Exact Mass282.21
IUPAC Name(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine
SMILESCC/C(=C/c1ccc2nc(C)ccc2c1)CNC(C)(C)C
InChIInChI=1S/C19H26N2/c1-6-15(13-20-19(3,4)5)11-16-8-10-18-17(12-16)9-7-14(2)21-18/h7-12,20H,6,13H2,1-5H3/b15-11-
InChIKeyOFXUZBZLFCDPGJ-PTNGSMBKSA-N
XLogP4.72
TPSA24.92 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500282.43
LogP ≤ 54.72
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

(Z)-N-tert-butyl-2-methyl-3-(2-methylquinolin-6-yl)prop-2-en-1-amine
CID 105379786
(2E)-2-[(2-methylquinolin-6-yl)methylidene]-N-propylbutan-1-amine
CID 105379764
N-[(2Z)-2-[(2-methylquinolin-6-yl)methylidene]butyl]cyclopropanamine
CID 105379766
N-tert-butyl-2-(pyridin-4-ylmethylidene)butan-1-amine
CID 79328789
4-(tert-butylamino)-2-(2-methylquinolin-6-yl)butan-2-ol
CID 81228162
(E)-3-methyl-4-(2-methylquinolin-6-yl)but-3-en-2-ol
CID 103091245
2-methyl-N-[2-(2-methylquinolin-6-yl)ethyl]propan-2-amine
CID 81224077
(E)-N-(2-methoxyethyl)-2-methyl-3-(2-methylquinolin-6-yl)prop-2-en-1-amine
CID 105379788
N-tert-butyl-2-(quinoxalin-2-ylmethylidene)butan-1-amine
CID 79329122
N-propan-2-yl-2-(quinolin-6-ylmethylidene)butan-1-amine
CID 79328770
N-tert-butyl-2-methyl-3-(2-methylquinolin-6-yl)propan-1-amine
CID 81222174
ethyl 3-(2-methylquinolin-6-yl)prop-2-enoate
CID 169480915

Frequently Asked Questions

What is the IUPAC name of (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine?
The IUPAC name of (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine (CID 105379767) is (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine.
What is the SMILES notation for (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine?
The canonical SMILES for (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine is CC/C(=C/c1ccc2nc(C)ccc2c1)CNC(C)(C)C.
What is the InChIKey of (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine?
The InChIKey is OFXUZBZLFCDPGJ-PTNGSMBKSA-N. The full InChI is InChI=1S/C19H26N2/c1-6-15(13-20-19(3,4)5)11-16-8-10-18-17(12-16)9-7-14(2)21-18/h7-12,20H,6,13H2,1-5H3/b15-11-.
What are the key properties of (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine?
(2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine has a molecular weight of 282.43 g/mol, XLogP of 4.72, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for (2Z)-N-tert-butyl-2-[(2-methylquinolin-6-yl)methylidene]butan-1-amine is sourced from PubChem (CID 105379767), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).