5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine

C19H27N3 — CID 102544692

IUPAC5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ncc(C(N)c2ccccc2)cc1C
InChIInChI=1S/C19H27N3/c1-4-11-22(12-5-2)19-15(3)13-17(14-21-19)18(20)16-9-7-6-8-10-16/h6-10,13-14,18H,4-5,11-12,20H2,1-3H3
InChIKeyXMLWPZJFOCEEPE-UHFFFAOYSA-N
MW297.45 g/mol
LogP4.06
Rot. Bonds7

About 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine

5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine (PubChem CID 102544692) has the molecular formula C19H27N3 and a molecular weight of 297.45 g/mol. Its IUPAC name is 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine.

Molecular Properties

Compound Name5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine
PubChem CID102544692
Molecular FormulaC19H27N3
Molecular Weight297.45 g/mol
Exact Mass297.22
IUPAC Name5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine
SMILESCCCN(CCC)c1ncc(C(N)c2ccccc2)cc1C
InChIInChI=1S/C19H27N3/c1-4-11-22(12-5-2)19-15(3)13-17(14-21-19)18(20)16-9-7-6-8-10-16/h6-10,13-14,18H,4-5,11-12,20H2,1-3H3
InChIKeyXMLWPZJFOCEEPE-UHFFFAOYSA-N
XLogP4.06
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms22
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500297.45
LogP ≤ 54.06
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

5-[amino(phenyl)methyl]-N,N,3-trimethylpyridin-2-amine
CID 102544582
5-[amino(phenyl)methyl]-N,3-dimethyl-N-phenylpyridin-2-amine
CID 102544727
5-[(R)-amino(phenyl)methyl]-4-methyl-N,N-dipropylpyridin-2-amine
CID 124501853
(1R)-1-[6-(dipropylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501331
(5-methyl-6-phenoxy-3-pyridinyl)-phenylmethanamine
CID 102544613
(NE)-N-[[6-(dipropylamino)-5-methyl-3-pyridinyl]methylidene]hydroxylamine
CID 102544681
4-[5-[(S)-amino(phenyl)methyl]-3-methyl-2-pyridinyl]piperazine-1-carbaldehyde
CID 124501535
6-[2-(dimethylamino)ethyl-propylamino]-5-methylpyridine-3-carboxylic acid
CID 80631658
5-(2-aminobutyl)-N,N-dibutyl-3-methylpyridin-2-amine
CID 80638929
(S)-[6-(dipropylamino)-3-pyridinyl]-phenylmethanol
CID 124502827
(1R)-1-[6-(diethylamino)-5-methyl-3-pyridinyl]propan-1-ol
CID 124501319
5-[(1S)-1-aminoethyl]-N-ethyl-N,3-dimethylpyridin-2-amine
CID 124501310

Frequently Asked Questions

What is the IUPAC name of 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine?
The IUPAC name of 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine (CID 102544692) is 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine.
What is the SMILES notation for 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine?
The canonical SMILES for 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine is CCCN(CCC)c1ncc(C(N)c2ccccc2)cc1C.
What is the InChIKey of 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine?
The InChIKey is XMLWPZJFOCEEPE-UHFFFAOYSA-N. The full InChI is InChI=1S/C19H27N3/c1-4-11-22(12-5-2)19-15(3)13-17(14-21-19)18(20)16-9-7-6-8-10-16/h6-10,13-14,18H,4-5,11-12,20H2,1-3H3.
What are the key properties of 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine?
5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine has a molecular weight of 297.45 g/mol, XLogP of 4.06, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 5-[amino(phenyl)methyl]-3-methyl-N,N-dipropylpyridin-2-amine is sourced from PubChem (CID 102544692), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).