4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine

C8H13N3 — CID 130680311

IUPAC4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine
SMILESCN[C@@H](C)c1ccncc1N
InChIInChI=1S/C8H13N3/c1-6(10-2)7-3-4-11-5-8(7)9/h3-6,10H,9H2,1-2H3/t6-/m0/s1
InChIKeyASCQXEGNYFNFOP-LURJTMIESA-N
MW151.21 g/mol
LogP0.94
Rot. Bonds2

About 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine

4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine (PubChem CID 130680311) has the molecular formula C8H13N3 and a molecular weight of 151.21 g/mol. Its IUPAC name is 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine.

Molecular Properties

Compound Name4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine
PubChem CID130680311
Molecular FormulaC8H13N3
Molecular Weight151.21 g/mol
Exact Mass151.11
IUPAC Name4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine
SMILESCN[C@@H](C)c1ccncc1N
InChIInChI=1S/C8H13N3/c1-6(10-2)7-3-4-11-5-8(7)9/h3-6,10H,9H2,1-2H3/t6-/m0/s1
InChIKeyASCQXEGNYFNFOP-LURJTMIESA-N
XLogP0.94
TPSA50.94 Ų
H-Bond Donors2
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms11
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500151.21
LogP ≤ 50.94
H-Bond Donors ≤ 52
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine?
The IUPAC name of 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine (CID 130680311) is 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine.
What is the SMILES notation for 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine?
The canonical SMILES for 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine is CN[C@@H](C)c1ccncc1N.
What is the InChIKey of 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine?
The InChIKey is ASCQXEGNYFNFOP-LURJTMIESA-N. The full InChI is InChI=1S/C8H13N3/c1-6(10-2)7-3-4-11-5-8(7)9/h3-6,10H,9H2,1-2H3/t6-/m0/s1.
What are the key properties of 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine?
4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine has a molecular weight of 151.21 g/mol, XLogP of 0.94, 2 rotatable bonds, 2 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for 4-[(1S)-1-(methylamino)ethyl]pyridin-3-amine is sourced from PubChem (CID 130680311), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).