N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine

C11H18N2 — CID 143947974

IUPACN-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine
SMILESCCCN(C)C(C)c1cccnc1
InChIInChI=1S/C11H18N2/c1-4-8-13(3)10(2)11-6-5-7-12-9-11/h5-7,9-10H,4,8H2,1-3H3
InChIKeyDUFPKGNJOFYNLM-UHFFFAOYSA-N
MW178.28 g/mol
LogP2.48
Rot. Bonds4

About N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine

N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine (PubChem CID 143947974) has the molecular formula C11H18N2 and a molecular weight of 178.28 g/mol. Its IUPAC name is N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine.

Molecular Properties

Compound NameN-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine
PubChem CID143947974
Molecular FormulaC11H18N2
Molecular Weight178.28 g/mol
Exact Mass178.15
IUPAC NameN-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine
SMILESCCCN(C)C(C)c1cccnc1
InChIInChI=1S/C11H18N2/c1-4-8-13(3)10(2)11-6-5-7-12-9-11/h5-7,9-10H,4,8H2,1-3H3
InChIKeyDUFPKGNJOFYNLM-UHFFFAOYSA-N
XLogP2.48
TPSA16.13 Ų
H-Bond Donors
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms13
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500178.28
LogP ≤ 52.48
H-Bond Donors ≤ 50
H-Bond Acceptors ≤ 102

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Related Compounds

N-[(3-chloro-4-pyridinyl)methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 77080069
(1R)-N-[(3-chloro-4-pyridinyl)methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 99820131
2-[propyl(1-pyridin-3-ylethyl)amino]acetic acid
CID 65064646
N-[(5-ethyl-1,2,4-oxadiazol-3-yl)methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 71908460
N-[(2-ethyl-1,2,4-triazol-3-yl)methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 56760298
(1R)-N-methyl-N-[(2-methylsulfanylpyrimidin-5-yl)methyl]-1-pyridin-3-ylethanamine
CID 95119543
2-(dipropylamino)-1-pyridin-3-ylethanol
CID 82216469
2-N,2-N-dimethyl-1-N-(1-pyridin-3-ylethyl)butane-1,2-diamine
CID 115886281
(1R)-N-[(2,3-dimethylimidazol-4-yl)methyl]-N-methyl-1-pyridin-3-ylethanamine
CID 99948670
(1R,2R)-N,N,2,3-tetramethyl-1-pyridin-3-ylbutan-1-amine
CID 130465955
2-(dimethylamino)-2-pyridin-3-ylethanol
CID 54775729
2-[methyl(1-pyridin-3-ylethyl)amino]-N-(2,2,2-trifluoroethyl)acetamide
CID 71906399

Frequently Asked Questions

What is the IUPAC name of N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine?
The IUPAC name of N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine (CID 143947974) is N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine.
What is the SMILES notation for N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine?
The canonical SMILES for N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine is CCCN(C)C(C)c1cccnc1.
What is the InChIKey of N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine?
The InChIKey is DUFPKGNJOFYNLM-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H18N2/c1-4-8-13(3)10(2)11-6-5-7-12-9-11/h5-7,9-10H,4,8H2,1-3H3.
What are the key properties of N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine?
N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine has a molecular weight of 178.28 g/mol, XLogP of 2.48, 4 rotatable bonds, 0 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-methyl-N-(1-pyridin-3-ylethyl)propan-1-amine is sourced from PubChem (CID 143947974), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).