N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine

C13H28N2 — CID 62575153

IUPACN-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine
SMILESCCC(CC)NCCN1CCCCC1C
InChIInChI=1S/C13H28N2/c1-4-13(5-2)14-9-11-15-10-7-6-8-12(15)3/h12-14H,4-11H2,1-3H3
InChIKeyNDWHWNUCFUMIPV-UHFFFAOYSA-N
MW212.38 g/mol
LogP2.64
Rot. Bonds6

About N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine

N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine (PubChem CID 62575153) has the molecular formula C13H28N2 and a molecular weight of 212.38 g/mol. Its IUPAC name is N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine.

Molecular Properties

Compound NameN-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine
PubChem CID62575153
Molecular FormulaC13H28N2
Molecular Weight212.38 g/mol
Exact Mass212.23
IUPAC NameN-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine
SMILESCCC(CC)NCCN1CCCCC1C
InChIInChI=1S/C13H28N2/c1-4-13(5-2)14-9-11-15-10-7-6-8-12(15)3/h12-14H,4-11H2,1-3H3
InChIKeyNDWHWNUCFUMIPV-UHFFFAOYSA-N
XLogP2.64
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds6
Heavy Atoms15
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500212.38
LogP ≤ 52.64
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

6-(2-methylpiperidin-1-yl)-N-propylhexan-3-amine
CID 106799179
2-methyl-N-[2-(2-methylpyrrolidin-1-yl)ethyl]pentan-3-amine
CID 115724992
3-methyl-N-[2-(2-methylpyrrolidin-1-yl)ethyl]butan-2-amine
CID 62573692
N-[2-(2-methylpiperidin-1-yl)ethyl]hex-5-en-2-amine
CID 104581801
N-[(2R)-1-hydroxybutan-2-yl]-3-[(2S)-2-methylpiperidin-1-yl]propanamide
CID 124878185
ethane;N-(2-pyrrolidin-1-ylethyl)pentan-3-amine
CID 142155161
3-(2-methylpiperidin-1-yl)-N-propylpropan-1-amine
CID 43193223
N-[2-(2-methylpyrrolidin-1-yl)ethyl]-1-(oxolan-2-yl)ethanamine
CID 62575881
4-(2-methylpiperidin-1-yl)-3-(propylamino)butan-1-ol
CID 64898364
1-[(2S)-butan-2-yl]-2-[2-[(2R)-2-methylpiperidin-1-yl]ethyl]guanidine
CID 124732340
2-methyl-1-pentylazepane
CID 134994557
N-[3-(2-methylpiperidin-1-yl)propyl]cyclohexanamine
CID 43178283

Frequently Asked Questions

What is the IUPAC name of N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine?
The IUPAC name of N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine (CID 62575153) is N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine.
What is the SMILES notation for N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine?
The canonical SMILES for N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine is CCC(CC)NCCN1CCCCC1C.
What is the InChIKey of N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine?
The InChIKey is NDWHWNUCFUMIPV-UHFFFAOYSA-N. The full InChI is InChI=1S/C13H28N2/c1-4-13(5-2)14-9-11-15-10-7-6-8-12(15)3/h12-14H,4-11H2,1-3H3.
What are the key properties of N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine?
N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine has a molecular weight of 212.38 g/mol, XLogP of 2.64, 6 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for N-[2-(2-methylpiperidin-1-yl)ethyl]pentan-3-amine is sourced from PubChem (CID 62575153), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).