N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine

C13H20N2O — CID 103761404

IUPACN-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine
SMILESCc1ccnc(NCCCOCC2CC2)c1
InChIInChI=1S/C13H20N2O/c1-11-5-7-15-13(9-11)14-6-2-8-16-10-12-3-4-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,14,15)
InChIKeyZYULNUKLETYFBG-UHFFFAOYSA-N
MW220.32 g/mol
LogP2.62
Rot. Bonds7

About N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine

N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine (PubChem CID 103761404) has the molecular formula C13H20N2O and a molecular weight of 220.32 g/mol. Its IUPAC name is N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine.

Molecular Properties

Compound NameN-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine
PubChem CID103761404
Molecular FormulaC13H20N2O
Molecular Weight220.32 g/mol
Exact Mass220.16
IUPAC NameN-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine
SMILESCc1ccnc(NCCCOCC2CC2)c1
InChIInChI=1S/C13H20N2O/c1-11-5-7-15-13(9-11)14-6-2-8-16-10-12-3-4-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,14,15)
InChIKeyZYULNUKLETYFBG-UHFFFAOYSA-N
XLogP2.62
TPSA34.15 Ų
H-Bond Donors1
H-Bond Acceptors3
Rotatable Bonds7
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500220.32
LogP ≤ 52.62
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 103

Computed Properties (RDKit)

Structural Alerts{'alert_name': 'Aliphatic_long_chain', 'substructure': 'N/A'}

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Related Compounds

4-methyl-N-(3-propoxypropyl)pyridin-2-amine
CID 82943413
4-methyl-N-[(3-methylcyclopentyl)methyl]pyridin-2-amine
CID 107413738
N-(4-chlorobutyl)-4-methylpyridin-2-amine
CID 106845034
N'-(4-methyl-2-pyridinyl)pentane-1,5-diamine
CID 107323471
4-N-[2-(cyclopropylmethoxy)ethyl]-6-N-propylpyrimidine-4,6-diamine
CID 114098683
N-[2-(2,2-difluoroethoxy)ethyl]-4-methylpyridin-2-amine
CID 103081298
methyl 5-[(4-methyl-2-pyridinyl)amino]pentanoate
CID 162756210
N-[3-(cyclopropylmethoxy)propyl]-4-methyl-2-nitroaniline
CID 103720881
N',N'-diethyl-N-(4-methyl-2-pyridinyl)butane-1,4-diamine
CID 22093246
4-methyl-N-(2-piperidin-3-ylethyl)pyridin-2-amine
CID 63629904
triethyl-[5-[(4-methyl-2-pyridinyl)amino]pentyl]azanium iodide
CID 160709638
6-[(4-methyl-2-pyridinyl)amino]hexanoic acid
CID 18518012

Frequently Asked Questions

What is the IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine?
The IUPAC name of N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine (CID 103761404) is N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine.
What is the SMILES notation for N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine?
The canonical SMILES for N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine is Cc1ccnc(NCCCOCC2CC2)c1.
What is the InChIKey of N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine?
The InChIKey is ZYULNUKLETYFBG-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H20N2O/c1-11-5-7-15-13(9-11)14-6-2-8-16-10-12-3-4-12/h5,7,9,12H,2-4,6,8,10H2,1H3,(H,14,15).
What are the key properties of N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine?
N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine has a molecular weight of 220.32 g/mol, XLogP of 2.62, 7 rotatable bonds, 1 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-[3-(cyclopropylmethoxy)propyl]-4-methylpyridin-2-amine is sourced from PubChem (CID 103761404), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).