N-benzyl-2-methylpropan-2-amine;piperidin-4-amine

C16H29N3 — CID 158253019

IUPACN-benzyl-2-methylpropan-2-amine;piperidin-4-amine
SMILESCC(C)(C)NCc1ccccc1.NC1CCNCC1
InChIInChI=1S/C11H17N.C5H12N2/c1-11(2,3)12-9-10-7-5-4-6-8-10;6-5-1-3-7-4-2-5/h4-8,12H,9H2,1-3H3;5,7H,1-4,6H2
InChIKeyGGYFTZYTDWNKDO-UHFFFAOYSA-N
MW263.43 g/mol
LogP2.27
Rot. Bonds2

About N-benzyl-2-methylpropan-2-amine;piperidin-4-amine

N-benzyl-2-methylpropan-2-amine;piperidin-4-amine (PubChem CID 158253019) has the molecular formula C16H29N3 and a molecular weight of 263.43 g/mol. Its IUPAC name is N-benzyl-2-methylpropan-2-amine;piperidin-4-amine.

Molecular Properties

Compound NameN-benzyl-2-methylpropan-2-amine;piperidin-4-amine
PubChem CID158253019
Molecular FormulaC16H29N3
Molecular Weight263.43 g/mol
Exact Mass263.24
IUPAC NameN-benzyl-2-methylpropan-2-amine;piperidin-4-amine
SMILESCC(C)(C)NCc1ccccc1.NC1CCNCC1
InChIInChI=1S/C11H17N.C5H12N2/c1-11(2,3)12-9-10-7-5-4-6-8-10;6-5-1-3-7-4-2-5/h4-8,12H,9H2,1-3H3;5,7H,1-4,6H2
InChIKeyGGYFTZYTDWNKDO-UHFFFAOYSA-N
XLogP2.27
TPSA50.08 Ų
H-Bond Donors3
H-Bond Acceptors3
Rotatable Bonds2
Heavy Atoms19
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500263.43
LogP ≤ 52.27
H-Bond Donors ≤ 53
H-Bond Acceptors ≤ 103

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Related Compounds

N-benzyl-2-methylpropan-2-amine;guanidine
CID 161475592
N-benzyl-2-piperidin-4-ylethanesulfonamide
CID 60890567
piperidin-4-amine;toluene;hydrate;dihydrochloride
CID 174417321
2-(benzylamino)-2-pyrrolidin-3-ylpropanenitrile
CID 130856941
N-[[4-[(tert-butylamino)methyl]phenyl]methyl]-2-methylpropan-2-amine
CID 22251747
2-methyl-N-[[4-(phenylmethoxymethyl)phenyl]methyl]propan-2-amine
CID 62446348
1-benzylpiperidin-4-amine;piperazine
CID 68641719
N-benzyl-1-[(3S)-pyrrolidin-3-yl]methanamine
CID 10726362
N-benzyl-2-cyclopentylpropan-2-amine
CID 115868314
N-(2-piperidin-4-ylethyl)aniline
CID 4778278
N-benzyl-5-methylazepan-4-amine
CID 174634749
hydroxy-(2-methyl-4-piperidin-4-ylbutan-2-yl)-diphenylsilane
CID 171400301

Frequently Asked Questions

What is the IUPAC name of N-benzyl-2-methylpropan-2-amine;piperidin-4-amine?
The IUPAC name of N-benzyl-2-methylpropan-2-amine;piperidin-4-amine (CID 158253019) is N-benzyl-2-methylpropan-2-amine;piperidin-4-amine.
What is the SMILES notation for N-benzyl-2-methylpropan-2-amine;piperidin-4-amine?
The canonical SMILES for N-benzyl-2-methylpropan-2-amine;piperidin-4-amine is CC(C)(C)NCc1ccccc1.NC1CCNCC1.
What is the InChIKey of N-benzyl-2-methylpropan-2-amine;piperidin-4-amine?
The InChIKey is GGYFTZYTDWNKDO-UHFFFAOYSA-N. The full InChI is InChI=1S/C11H17N.C5H12N2/c1-11(2,3)12-9-10-7-5-4-6-8-10;6-5-1-3-7-4-2-5/h4-8,12H,9H2,1-3H3;5,7H,1-4,6H2.
What are the key properties of N-benzyl-2-methylpropan-2-amine;piperidin-4-amine?
N-benzyl-2-methylpropan-2-amine;piperidin-4-amine has a molecular weight of 263.43 g/mol, XLogP of 2.27, 2 rotatable bonds, 3 hydrogen bond donors, and 3 hydrogen bond acceptors.
Where does this data come from?
All data for N-benzyl-2-methylpropan-2-amine;piperidin-4-amine is sourced from PubChem (CID 158253019), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).