6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine

C15H26N4 — CID 103937477

IUPAC6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)CC2CCCN2C)cn1
InChIInChI=1S/C15H26N4/c1-4-14(16)15-8-7-12(10-17-15)19(3)11-13-6-5-9-18(13)2/h7-8,10,13-14H,4-6,9,11,16H2,1-3H3/t13?,14-/m0/s1
InChIKeyQUZWGFANUUGDLA-KZUDCZAMSA-N
MW262.40 g/mol
LogP2.02
Rot. Bonds5

About 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine

6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine (PubChem CID 103937477) has the molecular formula C15H26N4 and a molecular weight of 262.40 g/mol. Its IUPAC name is 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine.

Molecular Properties

Compound Name6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine
PubChem CID103937477
Molecular FormulaC15H26N4
Molecular Weight262.40 g/mol
Exact Mass262.22
IUPAC Name6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine
SMILESCC[C@H](N)c1ccc(N(C)CC2CCCN2C)cn1
InChIInChI=1S/C15H26N4/c1-4-14(16)15-8-7-12(10-17-15)19(3)11-13-6-5-9-18(13)2/h7-8,10,13-14H,4-6,9,11,16H2,1-3H3/t13?,14-/m0/s1
InChIKeyQUZWGFANUUGDLA-KZUDCZAMSA-N
XLogP2.02
TPSA45.39 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds5
Heavy Atoms19
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500262.40
LogP ≤ 52.02
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Frequently Asked Questions

What is the IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine?
The IUPAC name of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine (CID 103937477) is 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine.
What is the SMILES notation for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine?
The canonical SMILES for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine is CC[C@H](N)c1ccc(N(C)CC2CCCN2C)cn1.
What is the InChIKey of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine?
The InChIKey is QUZWGFANUUGDLA-KZUDCZAMSA-N. The full InChI is InChI=1S/C15H26N4/c1-4-14(16)15-8-7-12(10-17-15)19(3)11-13-6-5-9-18(13)2/h7-8,10,13-14H,4-6,9,11,16H2,1-3H3/t13?,14-/m0/s1.
What are the key properties of 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine?
6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine has a molecular weight of 262.40 g/mol, XLogP of 2.02, 5 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for 6-[(1S)-1-aminopropyl]-N-methyl-N-[(1-methylpyrrolidin-2-yl)methyl]pyridin-3-amine is sourced from PubChem (CID 103937477), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).