N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine

C16H27N3 — CID 112584248

IUPACN-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine
SMILESCCCNC(CC)c1ccc(N(C)CC2CC2)cn1
InChIInChI=1S/C16H27N3/c1-4-10-17-15(5-2)16-9-8-14(11-18-16)19(3)12-13-6-7-13/h8-9,11,13,15,17H,4-7,10,12H2,1-3H3
InChIKeyRTFFJUMLBLFSGI-UHFFFAOYSA-N
MW261.41 g/mol
LogP3.38
Rot. Bonds8

About N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine

N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine (PubChem CID 112584248) has the molecular formula C16H27N3 and a molecular weight of 261.41 g/mol. Its IUPAC name is N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine.

Molecular Properties

Compound NameN-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine
PubChem CID112584248
Molecular FormulaC16H27N3
Molecular Weight261.41 g/mol
Exact Mass261.22
IUPAC NameN-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine
SMILESCCCNC(CC)c1ccc(N(C)CC2CC2)cn1
InChIInChI=1S/C16H27N3/c1-4-10-17-15(5-2)16-9-8-14(11-18-16)19(3)12-13-6-7-13/h8-9,11,13,15,17H,4-7,10,12H2,1-3H3
InChIKeyRTFFJUMLBLFSGI-UHFFFAOYSA-N
XLogP3.38
TPSA28.16 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds8
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500261.41
LogP ≤ 53.38
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

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Related Compounds

N-(cyclopropylmethyl)-6-[1-(ethylamino)propyl]-N-methylpyridin-3-amine
CID 112584247
N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)ethyl]pyridin-3-amine
CID 83123154
N-cyclopropyl-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 112584130
N-methyl-N-(oxolan-2-ylmethyl)-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939352
N-methyl-N-(3-methylbutyl)-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939346
6-[(1R)-1-aminopropyl]-N-(cyclopropylmethyl)-N-methylpyridin-3-amine
CID 103937043
N-cyclopropyl-N-propyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939237
N,N-dipropyl-6-[1-(propylamino)propyl]pyridin-3-amine
CID 115939175
3-[methyl-[6-[1-(propylamino)propyl]-3-pyridinyl]amino]propanenitrile
CID 112584090
2-[cyclopropyl-[6-[1-(propylamino)propyl]-3-pyridinyl]amino]ethanol
CID 115939423
(1R)-1-[5-[cyclopropylmethyl(methyl)amino]-2-pyridinyl]ethanol
CID 83132456
(1S)-1-[5-[cyclobutylmethyl(methyl)amino]-2-pyridinyl]propan-1-ol
CID 103938697

Frequently Asked Questions

What is the IUPAC name of N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine?
The IUPAC name of N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine (CID 112584248) is N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine.
What is the SMILES notation for N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine?
The canonical SMILES for N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine is CCCNC(CC)c1ccc(N(C)CC2CC2)cn1.
What is the InChIKey of N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine?
The InChIKey is RTFFJUMLBLFSGI-UHFFFAOYSA-N. The full InChI is InChI=1S/C16H27N3/c1-4-10-17-15(5-2)16-9-8-14(11-18-16)19(3)12-13-6-7-13/h8-9,11,13,15,17H,4-7,10,12H2,1-3H3.
What are the key properties of N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine?
N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine has a molecular weight of 261.41 g/mol, XLogP of 3.38, 8 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-(cyclopropylmethyl)-N-methyl-6-[1-(propylamino)propyl]pyridin-3-amine is sourced from PubChem (CID 112584248), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).