N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine

C16H27N3O — CID 62295141

IUPACN-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCOCCN(c1ccc(CNCC(C)C)cn1)C1CC1
InChIInChI=1S/C16H27N3O/c1-13(2)10-17-11-14-4-7-16(18-12-14)19(8-9-20-3)15-5-6-15/h4,7,12-13,15,17H,5-6,8-11H2,1-3H3
InChIKeyQLRPHWHCXMUSSK-UHFFFAOYSA-N
MW277.41 g/mol
LogP2.44
Rot. Bonds9

About N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine

N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine (PubChem CID 62295141) has the molecular formula C16H27N3O and a molecular weight of 277.41 g/mol. Its IUPAC name is N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine.

Molecular Properties

Compound NameN-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
PubChem CID62295141
Molecular FormulaC16H27N3O
Molecular Weight277.41 g/mol
Exact Mass277.22
IUPAC NameN-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
SMILESCOCCN(c1ccc(CNCC(C)C)cn1)C1CC1
InChIInChI=1S/C16H27N3O/c1-13(2)10-17-11-14-4-7-16(18-12-14)19(8-9-20-3)15-5-6-15/h4,7,12-13,15,17H,5-6,8-11H2,1-3H3
InChIKeyQLRPHWHCXMUSSK-UHFFFAOYSA-N
XLogP2.44
TPSA37.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds9
Heavy Atoms20
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500277.41
LogP ≤ 52.44
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-butyl-N-cyclopropyl-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 62283589
N-cyclopropyl-N-(cyclopropylmethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine
CID 64522855
N-cyclopropyl-N-(2-methoxyethyl)-6-[(2-methylpropylamino)methyl]pyridazin-3-amine
CID 62292853
N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]-N-propan-2-ylpyridin-2-amine
CID 82960066
N-cyclopropyl-N-(2-methoxyethyl)-4-[(2-methylpropylamino)methyl]pyridin-3-amine
CID 105073396
2-[cyclopropyl-[5-(ethylaminomethyl)-2-pyridinyl]amino]ethanol
CID 80629638
N-cyclohexyl-N-ethyl-5-[(2-methoxyethylamino)methyl]pyridin-2-amine
CID 80632112
N-methyl-5-[(2-methylpropylamino)methyl]-N-(2-propan-2-yloxyethyl)pyridin-2-amine
CID 81057672
5-[(2-methoxyethylamino)methyl]-N-methyl-N-(4-methylcyclohexyl)pyridin-2-amine
CID 80632155
N-cyclopropyl-N-ethyl-5-[(2-methylpropylamino)methyl]pyrimidin-2-amine
CID 113388029
N-cyclopropyl-N-ethyl-5-(propylaminomethyl)pyridin-2-amine
CID 62279551
N-butan-2-yl-5-(ethylaminomethyl)-N-(2-methoxyethyl)pyridin-2-amine
CID 62289550

Frequently Asked Questions

What is the IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The IUPAC name of N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine (CID 62295141) is N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine.
What is the SMILES notation for N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The canonical SMILES for N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine is COCCN(c1ccc(CNCC(C)C)cn1)C1CC1.
What is the InChIKey of N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
The InChIKey is QLRPHWHCXMUSSK-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3O/c1-13(2)10-17-11-14-4-7-16(18-12-14)19(8-9-20-3)15-5-6-15/h4,7,12-13,15,17H,5-6,8-11H2,1-3H3.
What are the key properties of N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine?
N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine has a molecular weight of 277.41 g/mol, XLogP of 2.44, 9 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N-cyclopropyl-N-(2-methoxyethyl)-5-[(2-methylpropylamino)methyl]pyridin-2-amine is sourced from PubChem (CID 62295141), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).