N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine

C11H19N3 — CID 165449038

IUPACN-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine
SMILESCCCN(C)Cc1cncc(CN)c1
InChIInChI=1S/C11H19N3/c1-3-4-14(2)9-11-5-10(6-12)7-13-8-11/h5,7-8H,3-4,6,9,12H2,1-2H3
InChIKeySCANOTHKNALYHR-UHFFFAOYSA-N
MW193.29 g/mol
LogP1.38
Rot. Bonds5

About N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine

N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine (PubChem CID 165449038) has the molecular formula C11H19N3 and a molecular weight of 193.29 g/mol. Its IUPAC name is N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine.

Molecular Properties

Compound NameN-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine
PubChem CID165449038
Molecular FormulaC11H19N3
Molecular Weight193.29 g/mol
Exact Mass193.16
IUPAC NameN-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine
SMILESCCCN(C)Cc1cncc(CN)c1
InChIInChI=1S/C11H19N3/c1-3-4-14(2)9-11-5-10(6-12)7-13-8-11/h5,7-8H,3-4,6,9,12H2,1-2H3
InChIKeySCANOTHKNALYHR-UHFFFAOYSA-N
XLogP1.38
TPSA42.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds5
Heavy Atoms14
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500193.29
LogP ≤ 51.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-[[4-(aminomethyl)phenyl]methyl]-N-methylpropan-1-amine
CID 43270951
5-(aminomethyl)-N,N-dimethylpyridin-3-amine
CID 59570189
N-methyl-N-[[4-[[methyl(propyl)amino]methyl]phenyl]methyl]propan-1-amine
CID 138737865
N-[[4-(aminomethyl)-2-fluorophenyl]methyl]-N-methylpropan-1-amine
CID 43270934
[3-[[methyl(pyridin-3-ylmethyl)amino]methyl]phenyl]methanamine
CID 43248750
N-[(5-ethyl-3-pyridinyl)methyl]-N-methyl-1-phenylmethanamine
CID 71051284
4-[[methyl(propyl)amino]methyl]aniline
CID 23506800
1-[5-(aminomethyl)-3-pyridinyl]butan-2-amine
CID 170890843
N-[[3-(aminomethyl)phenyl]methyl]-N-methyl-2-propoxyethanamine
CID 106450820
(5-fluoro-3-pyridinyl)methanamine;hydrochloride
CID 84819354
(5-fluoro-3-pyridinyl)methanamine;dihydrochloride
CID 119081474
4-[[methyl(propyl)amino]methyl]pyridine-2-carbothioamide
CID 63883438

Frequently Asked Questions

What is the IUPAC name of N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine?
The IUPAC name of N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine (CID 165449038) is N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine.
What is the SMILES notation for N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine?
The canonical SMILES for N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine is CCCN(C)Cc1cncc(CN)c1.
What is the InChIKey of N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine?
The InChIKey is SCANOTHKNALYHR-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H19N3/c1-3-4-14(2)9-11-5-10(6-12)7-13-8-11/h5,7-8H,3-4,6,9,12H2,1-2H3.
What are the key properties of N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine?
N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine has a molecular weight of 193.29 g/mol, XLogP of 1.38, 5 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[[5-(aminomethyl)-3-pyridinyl]methyl]-N-methylpropan-1-amine is sourced from PubChem (CID 165449038), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).