N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine

C17H30N4 — CID 106905586

IUPACN,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine
SMILESCC(C)NCc1cccc(CN(C)C2CCN(C)CC2)n1
InChIInChI=1S/C17H30N4/c1-14(2)18-12-15-6-5-7-16(19-15)13-21(4)17-8-10-20(3)11-9-17/h5-7,14,17-18H,8-13H2,1-4H3
InChIKeyAQQNNNMRNIHBSR-UHFFFAOYSA-N
MW290.46 g/mol
LogP2.11
Rot. Bonds6

About N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine

N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine (PubChem CID 106905586) has the molecular formula C17H30N4 and a molecular weight of 290.46 g/mol. Its IUPAC name is N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine.

Molecular Properties

Compound NameN,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine
PubChem CID106905586
Molecular FormulaC17H30N4
Molecular Weight290.46 g/mol
Exact Mass290.25
IUPAC NameN,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine
SMILESCC(C)NCc1cccc(CN(C)C2CCN(C)CC2)n1
InChIInChI=1S/C17H30N4/c1-14(2)18-12-15-6-5-7-16(19-15)13-21(4)17-8-10-20(3)11-9-17/h5-7,14,17-18H,8-13H2,1-4H3
InChIKeyAQQNNNMRNIHBSR-UHFFFAOYSA-N
XLogP2.11
TPSA31.40 Ų
H-Bond Donors1
H-Bond Acceptors4
Rotatable Bonds6
Heavy Atoms21
Complexity—

Lipinski Rule of Five

Passes Rule of Five

RuleValue
MW ≤ 500290.46
LogP ≤ 52.11
H-Bond Donors ≤ 51
H-Bond Acceptors ≤ 104

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Related Compounds

N-[[6-[[methyl(oxan-4-ylmethyl)amino]methyl]-2-pyridinyl]methyl]propan-2-amine
CID 106906639
N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]propan-2-amine;dihydrobromide
CID 11545437
N-[[6-[[methyl(oxan-2-ylmethyl)amino]methyl]-2-pyridinyl]methyl]propan-2-amine
CID 106906089
1-ethyl-N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N-methylpiperidin-4-amine
CID 106906287
N,2-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]butan-1-amine
CID 106905796
N-[[6-(ethylaminomethyl)-2-pyridinyl]methyl]-N-methylcyclohexanamine
CID 106905571
N-methyl-N-[[6-(propylaminomethyl)-2-pyridinyl]methyl]cyclohexanamine
CID 106905570
N-(cyclopropylmethyl)-N-methyl-6-[(propan-2-ylamino)methyl]pyridin-2-amine
CID 62284019
N-[[6-[(2-propan-2-ylpyrrolidin-1-yl)methyl]-2-pyridinyl]methyl]propan-2-amine
CID 106906796
N-[[6-(4-methylpiperidin-1-yl)-2-pyridinyl]methyl]propan-2-amine
CID 62286089
1-cyclohexyl-N-methyl-N-[[6-(methylaminomethyl)-2-pyridinyl]methyl]methanamine
CID 106905342
4-fluoro-N-methyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]aniline
CID 106906209

Frequently Asked Questions

What is the IUPAC name of N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine?
The IUPAC name of N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine (CID 106905586) is N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine.
What is the SMILES notation for N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine?
The canonical SMILES for N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine is CC(C)NCc1cccc(CN(C)C2CCN(C)CC2)n1.
What is the InChIKey of N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine?
The InChIKey is AQQNNNMRNIHBSR-UHFFFAOYSA-N. The full InChI is InChI=1S/C17H30N4/c1-14(2)18-12-15-6-5-7-16(19-15)13-21(4)17-8-10-20(3)11-9-17/h5-7,14,17-18H,8-13H2,1-4H3.
What are the key properties of N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine?
N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine has a molecular weight of 290.46 g/mol, XLogP of 2.11, 6 rotatable bonds, 1 hydrogen bond donors, and 4 hydrogen bond acceptors.
Where does this data come from?
All data for N,1-dimethyl-N-[[6-[(propan-2-ylamino)methyl]-2-pyridinyl]methyl]piperidin-4-amine is sourced from PubChem (CID 106905586), the world's largest open chemistry database maintained by the National Library of Medicine (NIH).