N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine

C15H25N3 — CID 112584247

IUPACN-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)CC2CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-14(16-5-2)15-9-8-13(10-17-15)18(3)11-12-6-7-12/h8-10,12,14,16H,4-7,11H2,1-3H3
InChIKeyBRMCJRKHRSBDTR-UHFFFAOYSA-N
MW247.39 g/mol
LogP2.99
Rot. Bonds7

About N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine

N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine (PubChem CID 112584247) has the molecular formula C15H25N3 and a molecular weight of 247.39 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
PubChem CID112584247
Molecular FormulaC15H25N3
Molecular Weight247.39 g/mol
Exact Mass247.20
IUPAC NameN-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
SMILESCCNC(CC)c1ccc(N(C)CC2CC2)cn1
InChIInChI=1S/C15H25N3/c1-4-14(16-5-2)15-9-8-13(10-17-15)18(3)11-12-6-7-12/h8-10,12,14,16H,4-7,11H2,1-3H3
InChIKeyBRMCJRKHRSBDTR-UHFFFAOYSA-N
XLogP2.99
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms18
Complexity

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500247.39
LogP ≤ 52.99
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The IUPAC name of N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine (CID 112584247) is N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The canonical SMILES for N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine is CCNC(CC)c1ccc(N(C)CC2CC2)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
The InChIKey is BRMCJRKHRSBDTR-UHFFFAOYSA-N. The full InChI is InChI=1S/C15H25N3/c1-4-14(16-5-2)15-9-8-13(10-17-15)18(3)11-12-6-7-12/h8-10,12,14,16H,4-7,11H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine?
N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine has a molecular weight of 247.39 g/mol, XLogP of 2.99, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine is sourced from PubChem (CID 112584247), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).