ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine

C14H32N2 — CID 170571754

IUPACethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine
SMILESCC.CCCNC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C12H26N2.C2H6/c1-5-8-13-12(4)6-9-14(10-7-12)11(2)3;1-2/h11,13H,5-10H2,1-4H3;1-2H3
InChIKeyWBFZGVQHPSVPGQ-UHFFFAOYSA-N
MW228.42 g/mol
LogP3.28
Rot. Bonds4

About ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine

ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine (PubChem CID 170571754) has the molecular formula C14H32N2 and a molecular weight of 228.42 g/mol. Its IUPAC name is ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine.

Molecular Properties

Compound Nameethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine
PubChem CID170571754
Molecular FormulaC14H32N2
Molecular Weight228.42 g/mol
Exact Mass228.26
IUPAC Nameethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine
SMILESCC.CCCNC1(C)CCN(C(C)C)CC1
InChIInChI=1S/C12H26N2.C2H6/c1-5-8-13-12(4)6-9-14(10-7-12)11(2)3;1-2/h11,13H,5-10H2,1-4H3;1-2H3
InChIKeyWBFZGVQHPSVPGQ-UHFFFAOYSA-N
XLogP3.28
TPSA15.27 Ų
H-Bond Donors1
H-Bond Acceptors2
Rotatable Bonds4
Heavy Atoms16
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500228.42
LogP ≤ 53.28
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 102

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Related Compounds

1-propan-2-yl-4-(propylamino)piperidine-4-carboxylic acid
CID 43754005
3-(difluoromethyl)-1-propan-2-yl-N-propylpyrrolidin-3-amine
CID 80605774
1-propan-2-yl-4,4-dipropylpiperidine
CID 89468851
(3S)-N,3-dimethyl-1-propan-2-ylpyrrolidin-3-amine
CID 166707515
1,4-dimethyl-N-propylcyclohexan-1-amine
CID 130638305
(4-methyl-1-propan-2-ylpiperidin-4-yl)phosphane
CID 175635218
4-fluoro-1-propan-2-ylpiperidine-4-sulfonamide
CID 126737674
4-iodo-1-propan-2-ylpiperidin-4-amine
CID 155455763
ethane;1-methyl-N-pentylcyclobutan-1-amine
CID 164868131
2,2-dimethyl-6-(4-propan-2-ylpiperazin-1-yl)-N-propylcyclohexan-1-amine
CID 79835826
(4-hydroxy-1-propan-2-ylpiperidin-4-yl)methyl hypoiodite
CID 155039158
4-nonyl-1-propan-2-ylpiperidin-4-ol
CID 65146910

Frequently Asked Questions

What is the IUPAC name of ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine?
The IUPAC name of ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine (CID 170571754) is ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine.
What is the SMILES notation for ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine?
The canonical SMILES for ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine is CC.CCCNC1(C)CCN(C(C)C)CC1.
What is the InChIKey of ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine?
The InChIKey is WBFZGVQHPSVPGQ-UHFFFAOYSA-N. The full InChI is InChI=1S/C12H26N2.C2H6/c1-5-8-13-12(4)6-9-14(10-7-12)11(2)3;1-2/h11,13H,5-10H2,1-4H3;1-2H3.
What are the key properties of ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine?
ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine has a molecular weight of 228.42 g/mol, XLogP of 3.28, 4 rotatable bonds, 1 hydrogen bond donors, and 2 hydrogen bond acceptors.
Where does this data come from?
All data for ethane;4-methyl-1-propan-2-yl-N-propylpiperidin-4-amine is sourced from PubChem (CID 170571754), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).